UCSF

ZINC01161336

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2005 32 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 3.94 1.8 -52.39 2 6 1 71 437.56 9
Mid Mid (pH 6-8) 3.35 1.7 -63.45 1 6 1 68 437.56 9

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