UCSF

ZINC71555265

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 21 No

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Annotations

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Vendors

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 1.94 -22.4 1 6 0 79 329.447 5
Mid Mid (pH 6-8) 0.90 4.68 -62.15 2 6 1 81 330.455 5

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

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