UCSF

ZINC34985816

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 33 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) 2.49 1.68 -52.62 1 11 -1 151 466.455 7
Mid Mid (pH 6-8) 2.67 2.8 -16.76 2 11 0 152 467.463 6

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