UCSF

ZINC40978584

Substance Information

In ZINC since Heavy atoms Benign functionality
April 14th, 2010 24 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) 4.27 9.16 -17.65 1 5 0 60 342.42 7
Hi High (pH 8-9.5) 4.45 6.58 -47.54 0 5 -1 67 341.412 7

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