UCSF

ZINC34885234

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 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) -1.55 -0.93 -57.63 10 12 1 194 409.452 5
Hi High (pH 8-9.5) -1.07 -1.96 -62.35 9 12 0 195 408.444 4

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