UCSF

ZINC59089374

Substance Information

In ZINC since Heavy atoms Benign functionality
February 24th, 2011 16 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) 3.09 5.71 -39.62 4 4 1 63 230.376 10
Hi High (pH 8-9.5) 3.09 3.41 -4.77 3 4 0 62 229.368 10

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