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Chemistry Data Science Jobs (NOW HIRING)

Mat3ra

Lead Software Engineer (Node.js)

Walnut Creek, CA · On-site +1

$120K - $180K/yr

Overview We look for Senior Engineers excited about bridging the gap between materials/chemistry, data science, and computer science to help us develop a software framework for designing and ...

Mat3ra

☁ Cloud HPC Engineer ☁

Walnut Creek, CA · On-site

$130K - $200K/yr

V.I.S. for materials RnD ( -man-creates-material.gif) and looking for Senior Engineers excited about bridging the gap between materials/chemistry, data science, and computer science to help us ...

Mat3ra

Lead Software Engineer (Node.js)

Walnut Creek, CA · On-site +1

$120K - $180K/yr

Overview We look for Senior Engineers excited about bridging the gap between materials/chemistry, data science, and computer science to help us develop a software framework for designing and ...

Mat3ra

Head of Engineering

Walnut Creek, CA · On-site +1

$130K - $200K/yr

Overview We look for Senior Engineers excited about bridging the gap between materials/chemistry, data science, and computer science to help us develop a software framework for designing and ...

Mat3ra

Head of Engineering

Walnut Creek, CA · On-site

$130K - $200K/yr

Overview We look for Senior Engineers excited about bridging the gap between materials/chemistry, data science, and computer science to help us develop a software framework for designing and ...

Mat3ra

Cloud HPC Engineer

Walnut Creek, CA · On-site +1

$130K - $200K/yr

S. for materials RnD ( and looking for Senior Engineers excited about bridging the gap between materials/chemistry, data science, and computer science to help us develop a software framework for ...

Wood Plc

Marine/Aquatic Scientist

San Diego, CA · On-site

Reviewing and analyzing sediment and water chemistry data and toxicology laboratory results * Drafting sampling and analysis plans and field work preparation * Writing scientific reports, including ...

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How much do chemistry data science jobs pay per year?

As of Jun 11, 2026, the average yearly pay for chemistry data science in the United States is $122,738.00, according to ZipRecruiter salary data. Most workers in this role earn between $98,500.00 and $136,000.00 per year, depending on experience, location, and employer.

Can you do data science with a chemistry degree?

A chemistry degree provides a strong foundation for data science roles, especially in industries like pharmaceuticals, materials, and environmental science. Skills in programming, statistics, and data analysis tools such as Python, R, and SQL are often required to succeed in data science positions related to chemistry. Additional training or certifications in data science can enhance job prospects in this field.

Is a BS degree in data science worth it?

A BS degree in data science is valuable for chemistry data science roles, as it provides foundational skills in programming, statistics, and data analysis essential for interpreting chemical data. Many employers prefer candidates with a formal education in data science or related fields, and the degree can improve job prospects and earning potential in this specialized area.

Is 30 too late for data science?

Chemistry Data Science is a field that values skills and experience over age; many professionals transition into data science later in their careers. Gaining proficiency in programming languages like Python or R, and understanding data analysis tools, can help regardless of age. Age should not be a barrier to entering the field if you develop relevant skills and stay current with industry trends.

What are some typical responsibilities of a Chemistry Data Science professional in an industrial or research setting?

Chemistry Data Science professionals are often tasked with analyzing large datasets derived from laboratory experiments or chemical manufacturing processes to uncover patterns, improve yields, or predict properties of new compounds. On a day-to-day basis, they may design predictive models, collaborate with chemists and engineers, and use advanced software to manage and interpret chemical data. The role frequently involves presenting findings to cross-functional teams and supporting decision-making through evidence-based recommendations. This collaborative approach helps drive innovation and efficiency in product development, quality control, or scientific research projects.

What is a Chemistry Data Science job?

A Chemistry Data Science job involves applying data analysis, machine learning, and computational techniques to solve problems in chemistry. Professionals in this field work with large datasets from experiments, simulations, or literature to extract insights, optimize processes, and make predictions. Common applications include drug discovery, materials science, chemical informatics, and reaction optimization. This role typically requires expertise in chemistry, programming (e.g., Python, R), and statistical modeling.

What are the key skills and qualifications needed to thrive in the Chemistry Data Science position, and why are they important?

To excel in Chemistry Data Science, a strong background in chemistry combined with data analysis skills, usually evidenced by a degree in chemistry, chemical engineering, or a related field along with experience in statistics or data science, is essential. Familiarity with scientific computing, statistical programming languages like Python or R, and data visualization tools, as well as experience with cheminformatics databases, are typically required. Strong problem-solving, collaboration, and communication abilities set candidates apart in this interdisciplinary field. These skills are crucial for extracting actionable insights from complex chemical data, enabling informed decision-making and innovation in research or industry settings.

Do computational chemists make good money?

Computational chemists typically earn competitive salaries that vary based on experience, education, and industry sector, such as pharmaceuticals or materials science. Entry-level positions may start around $60,000 to $80,000 annually, with experienced professionals earning over $100,000, especially if they have advanced skills in programming, modeling, and data analysis. Salary potential increases with specialization, certifications, and working in high-demand research environments.
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Chemistry Data Science jobs near you
Scientist II, Cheminformatics

Scientist II, Cheminformatics

Relay Therapeutics

Cambridge, MA • On-site

$88K - $126K/yr

Full-time

Posted 8 days ago

Job description

The Opportunity:
Relay Therapeutics is seeking a highly motivated Scientist to join our Drug Discovery team in a unique hybrid role that integrates synthetic chemistry with cheminformatics. This position is ideal for a scientist who enjoys working at the interface of experimental and computational disciplines and is excited to help shape how data-driven chemistry is done in a modern biotech environment.
Your Role:
  • Maintain and support tools used in compound registration, lab operations and data ingestion from assays, as well as broader data and software access workflows
  • Design and execute synthetic chemistry workflows, with a focus on high-throughput or parallel synthesis to support medicinal chemistry programs
  • Contribute to the design, enumeration, and prioritization of compound libraries using cheminformatics tools
  • Collaborate closely with computational chemists, data scientists, and medicinal chemists to guide compound design using data-driven insights
  • Analyze and interpret experimental data to inform structure-activity relationships (SAR) and compound optimization
  • Help develop and refine internal workflows that integrate synthetic chemistry with computational approaches
  • Maintain clear documentation and communicate results effectively across multidisciplinary teams

Your Background:
  • Ph.D. or M.S. in Organic Chemistry or a related field, with 2-5 years of relevant industry experience preferred
  • Demonstrated experience in synthetic organic chemistry
  • Familiarity with cheminformatics tools and concepts (e.g., molecular representations, library design, property prediction)
  • Experience with scripting or data analysis tools (e.g., Python, RDKit)
  • Strong problem-solving skills and the ability to work both independently and collaboratively
  • Excellent communication skills and a desire to work in a highly cross-functional environment

What We're Looking For
  • A scientist who enjoys bridging "hands-on" chemistry with computational thinking
  • Someone comfortable working in a fast-paced, evolving biotech setting
  • A candidate who is curious, adaptable, and interested in shaping new ways of integrating chemistry and data science

Estimated Salary Range: [$88,000-$126,000].
The range provided above is based on what we believe to be a reasonable estimate for this job at the time of posting. Actual base salary will depend on a number of factors, including but not limited to, a candidate's education, experience, skills and location.
#BP1
About Relay Therapeutics
Relay Therapeutics is a clinical-stage precision medicines company transforming the drug discovery process with the goal of bringing life-changing therapies to patients. Built on unparalleled insights into protein motion and how this dynamic behavior relates to protein function, we aim to effectively drug protein targets that have previously been intractable, with an initial focus on enhancing small molecule therapeutic discovery in targeted oncology. Our Dynamo platform integrates an array of leading-edge experimental and computational approaches to provide a differentiated understanding of protein structure and motion to drug these targets. We have built a world-class team of leading experts from each of these disciplines, and they are driven by a deep collaboration at every step of our drug discovery process.
Our team is equal parts fearless and relentless, with a shared passion for working collaboratively in intellectually stimulating environments. If you're excited by the challenge of putting protein motion at the heart of drug discovery and passionate about making a difference in the lives of patients, join us!

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