UCSF

ZINC20478573

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2008 21 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) 2.68 5.46 -57.79 1 6 -1 82 278.295 3
Lo Low (pH 4.5-6) 2.68 5.59 -15.63 2 6 0 84 279.303 3

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