UCSF

ZINC45291089

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2010 23 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) 3.02 9.26 -8.87 0 3 0 24 308.425 3
Mid Mid (pH 6-8) 3.02 11.14 -45.37 1 3 1 25 309.433 3

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