UCSF

ZINC71555689

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 22 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) 1.40 4.83 -14.2 1 6 0 67 318.402 5
Mid Mid (pH 6-8) 1.40 7.56 -52.39 2 6 1 68 319.41 5

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

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