UCSF

ZINC44456869

Substance Information

In ZINC since Heavy atoms Benign functionality
May 29th, 2010 28 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 1.90 3.85 -17.45 1 10 0 125 414.484 8
Mid Mid (pH 6-8) 1.90 6.05 -64.31 2 10 1 126 415.492 8

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