UCSF

ZINC40192087

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 29 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) 2.56 10.32 -19.37 1 6 0 67 390.487 7
Lo Low (pH 4.5-6) 2.56 10.76 -33.54 2 6 1 68 391.495 7

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