UCSF

ZINC19432432

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 17 No

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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) -0.33 0.31 -9.89 3 6 0 84 236.275 2
Mid Mid (pH 6-8) -0.33 0.6 -40.25 4 6 1 85 237.283 2

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

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