UCSF

ZINC95081983

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2013 19 No

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Annotations

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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) 1.28 0.13 -7.13 0 6 0 65 286.401 4
Mid Mid (pH 6-8) 1.28 2.34 -46.38 1 6 1 67 287.409 4

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

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