UCSF

ZINC40184869

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 23 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) 1.01 5.21 -11.55 1 6 0 69 310.357 6
Mid Mid (pH 6-8) 1.01 5.7 -29.61 2 6 1 70 311.365 6

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