UCSF

ZINC40192776

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 34 Yes

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 5.79 14.66 -14.59 1 4 0 47 449.529 7
Lo Low (pH 4.5-6) 5.79 15.86 -36.77 2 4 1 48 450.537 7

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