UCSF

ZINC40655893

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2010 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) -1.23 -1.11 -45.41 4 10 -1 159 326.229 4
Mid Mid (pH 6-8) -1.23 0.01 -131.44 3 10 -2 162 325.221 4
Mid Mid (pH 6-8) -1.23 -1.11 -45.42 4 10 -1 159 326.229 4

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

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