UCSF

ZINC49590071

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 54 No

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Annotations

Vendors

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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) 2.63 15.93 -137.97 4 14 2 157 748.874 14
Hi High (pH 8-9.5) 2.63 11.49 -36.27 2 14 0 154 746.858 14
Mid Mid (pH 6-8) 2.63 13.72 -77.53 3 14 1 155 747.866 14

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