UCSF

ZINC40659845

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2010 21 No

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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) 0.90 5.63 -26.35 3 9 0 133 289.251 4
Mid Mid (pH 6-8) 1.36 3.03 -50.99 2 9 -1 136 288.243 4

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

No pre-computed analogs available. Try a structural similarity search.