UCSF

ZINC08701836

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2007 14 Yes

Popular Name: 2-pyrrolidin-1-ylbenzoic acid 2-pyrrolidin-1-ylbenzoic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 10314-35-9 , 78648-27-8

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) 2.49 5.62 -57.11 0 3 -1 43 190.222 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 87 - 89 Enamine Building Blocks
MP 87...89 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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