UCSF

ZINC40177032

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) 3.73 9.93 -14.57 2 5 0 75 417.412 3
Mid Mid (pH 6-8) 5.03 9.71 -47.08 1 5 -1 78 416.404 3

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