UCSF

ZINC40226770

Substance Information

In ZINC since Heavy atoms Benign functionality
April 4th, 2010 32 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) 7.35 17.3 -8.44 0 3 0 27 426.604 8
Mid Mid (pH 6-8) 7.35 17.59 -27.31 1 3 1 28 427.612 8

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