UCSF

ZINC39869814

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 24 No

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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) 2.86 2.02 -54.05 3 6 -1 107 338.368 4
Hi High (pH 8-9.5) 2.86 2.79 -112.39 2 6 -2 110 337.36 4
Mid Mid (pH 6-8) 2.86 2.76 -17.1 4 6 0 105 339.376 4

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