UCSF

ZINC41786612

Substance Information

In ZINC since Heavy atoms Benign functionality
April 22nd, 2010 18 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) 1.20 4.75 -26.81 1 6 0 92 280.334 5
Mid Mid (pH 6-8) 1.39 3.28 -49.33 0 6 -1 98 279.326 5

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

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