UCSF

ZINC05376984

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2006 23 No

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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) 5.72 9.25 -7.84 1 3 0 45 326.396 3
Mid Mid (pH 6-8) 5.23 9.18 -41.85 0 3 -1 44 325.388 4

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