UCSF

ZINC19488582

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2008 8 No

Popular Name: pyrrolidin-1-ylacetonitrile pyrrolidin-1-ylacetonitrile

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CAS Numbers: 1152964-31-2 , 29134-29-0 , 573987-48-1

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.53 1.75 -5.99 0 2 0 27 110.16 1 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings TOXIC Matrix Scientific

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Analogs ( Draw Identity 99% 90% 80% 70% )