UCSF

ZINC34949267

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 31 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) 3.99 7.44 -13.53 0 8 0 96 488.393 9
Mid Mid (pH 6-8) 3.99 9.78 -43.37 1 8 1 97 489.401 9

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