UCSF

ZINC34684737

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 25 Yes

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) 3.23 9.52 -49.71 2 5 1 50 342.463 6
Mid Mid (pH 6-8) 3.23 7.3 -8.37 1 5 0 49 341.455 6

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