UCSF

ZINC06265582

Substance Information

In ZINC since Heavy atoms Benign functionality
March 17th, 2006 28 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.67 7.32 -10.28 2 7 0 127 377.448 3
Mid Mid (pH 6-8) 2.75 2 -40.53 2 7 1 126 378.456 3

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