UCSF

ZINC10020207

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2007 30 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) 4.69 -0.42 -24.13 0 4 0 46 454.02 8
Lo Low (pH 4.5-6) 4.69 -0.31 -57.32 1 4 1 47 455.028 8

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