UCSF

ZINC31909280

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 22 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) 1.67 8.67 -63.12 1 8 0 108 306.322 7
Mid Mid (pH 6-8) 1.67 6.38 -50.14 0 8 -1 106 305.314 7
Lo Low (pH 4.5-6) 1.67 9.07 -85.37 2 8 1 109 307.33 7

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