UCSF

ZINC04458883

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2005 29 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) 5.05 -0.43 -14.58 1 6 0 71 390.487 3

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