UCSF

ZINC40186040

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) 2.96 10.25 -17.99 1 6 0 67 390.487 5
Mid Mid (pH 6-8) 2.96 10.81 -37.09 2 6 1 68 391.495 5

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