UCSF

ZINC27693240

Substance Information

In ZINC since Heavy atoms Benign functionality
February 19th, 2009 29 Yes

Download: MOL2 SDF SMILES Flexibase

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) 5.12 13.97 -17.92 0 4 0 38 381.479 4
Lo Low (pH 4.5-6) 5.12 14.37 -40.89 1 4 1 39 382.487 4

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