UCSF

ZINC09545612

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2007 30 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) 4.97 -0.89 -16.49 0 4 0 46 498.471 7
Lo Low (pH 4.5-6) 4.97 -0.78 -49.4 1 4 1 47 499.479 7

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