UCSF

ZINC33750158

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2009 33 Yes

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) 3.38 9.05 -16.66 1 7 0 65 476.618 10
Mid Mid (pH 6-8) 3.38 11.37 -52.38 2 7 1 66 477.626 10

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