UCSF

ZINC40858669

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2010 34 Yes

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Annotations

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) 6.34 14.42 -15.15 1 5 0 60 472.61 9
Hi High (pH 8-9.5) 6.53 11.87 -44.94 0 5 -1 67 471.602 9

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