UCSF

ZINC39975099

Substance Information

In ZINC since Heavy atoms Benign functionality
March 20th, 2010 28 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) 4.39 7.72 -12.24 0 7 0 86 464.758 5
Mid Mid (pH 6-8) 4.39 9.95 -55.61 1 7 1 88 465.766 5

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