UCSF

ZINC40187810

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 24 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) 3.96 8.79 -8.67 1 4 0 47 362.26 4
Lo Low (pH 4.5-6) 3.96 9.44 -32.55 2 4 1 48 363.268 4

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