UCSF

ZINC39853925

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 26 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) 3.70 7.88 -16.87 1 6 0 73 354.406 5
Hi High (pH 8-9.5) 3.70 9.01 -68.5 0 6 -1 76 353.398 5
Hi High (pH 8-9.5) 3.70 8.18 -61.94 0 6 -1 76 353.398 5

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