UCSF

ZINC40169773

Substance Information

In ZINC since Heavy atoms Benign functionality
April 1st, 2010 17 Yes

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Annotations

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) 1.00 7.81 -38.72 1 4 0 58 234.23 2
Hi High (pH 8-9.5) 1.00 7.4 -45.06 0 4 -1 56 233.222 2

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