UCSF

ZINC40175255

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 29 Yes

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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) 4.39 13.88 -40.52 1 5 1 47 410.925 6
Mid Mid (pH 6-8) 4.39 11.65 -6.25 0 5 0 46 409.917 6
Mid Mid (pH 6-8) 4.39 12.03 -27.81 1 5 1 47 410.925 6
Mid Mid (pH 6-8) 4.39 14.27 -83.17 2 5 2 48 411.933 6

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