UCSF

ZINC31862427

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 22 No

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Annotations

Vendors

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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) 2.79 7.2 -45.43 3 5 1 66 321.422 6
Mid Mid (pH 6-8) 2.79 4.59 -10.59 2 5 0 65 320.414 6

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