UCSF

ZINC39853918

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) 4.25 8.17 -14.17 1 5 0 64 324.38 5
Hi High (pH 8-9.5) 4.25 9.29 -65.92 0 5 -1 67 323.372 5
Hi High (pH 8-9.5) 4.25 8.47 -59.26 0 5 -1 67 323.372 5

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