UCSF

ZINC39854017

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 27 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) 6.05 9.84 -13.05 1 5 0 64 431.33 7
Hi High (pH 8-9.5) 6.05 10.96 -63.91 0 5 -1 67 430.322 7
Hi High (pH 8-9.5) 6.05 10.19 -57.65 0 5 -1 67 430.322 7

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