UCSF

ZINC40232889

Substance Information

In ZINC since Heavy atoms Benign functionality
April 4th, 2010 29 Yes

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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) 7.19 14.76 -11.71 0 3 0 27 404.941 6
Lo Low (pH 4.5-6) 7.19 15.47 -30.98 1 3 1 28 405.949 6

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

No pre-computed analogs available. Try a structural similarity search.