UCSF

ZINC40188351

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 33 Yes

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Annotations

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) 5.05 13.32 -16.16 1 6 0 67 446.595 7
Mid Mid (pH 6-8) 5.05 13.86 -37.6 2 6 1 68 447.603 7

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