UCSF

ZINC40177000

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 25 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) 2.54 7.87 -10.03 2 4 0 62 350.271 3
Mid Mid (pH 6-8) 3.84 7.61 -45.68 1 4 -1 65 349.263 3

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