UCSF

ZINC06259868

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2006 24 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) 4.75 10.47 -14.63 1 4 0 51 340.448 5
Hi High (pH 8-9.5) 4.93 7.99 -47.89 0 4 -1 58 339.44 5

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