UCSF

ZINC33703748

Substance Information

In ZINC since Heavy atoms Benign functionality
July 16th, 2009 35 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) -0.40 4.2 -39.68 5 11 0 168 490.557 11
Hi High (pH 8-9.5) -0.40 1.93 -62.33 4 11 -1 163 489.549 11
Hi High (pH 8-9.5) -0.40 3.1 -53.88 4 11 -1 163 489.549 11

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