UCSF

ZINC40147266

Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2010 33 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) 4.13 9.47 -17.38 1 8 0 103 465.531 9
Mid Mid (pH 6-8) 4.32 7.99 -46.09 0 8 -1 109 464.523 9

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