UCSF

ZINC40274738

Substance Information

In ZINC since Heavy atoms Benign functionality
April 4th, 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) 3.96 10.54 -11.99 1 4 0 47 333.435 6
Mid Mid (pH 6-8) 3.96 10.98 -33.6 2 4 1 48 334.443 6

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