UCSF

ZINC39917753

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 29 Yes

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 6.60 16.43 -47.24 1 3 1 22 390.595 7
Lo Low (pH 4.5-6) 6.60 16.62 -99.48 2 3 2 24 391.603 7

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