UCSF

ZINC52850235

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 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) -0.26 2.6 -49.83 4 7 1 95 300.379 7
Mid Mid (pH 6-8) -0.26 0.39 -18.57 3 7 0 94 299.371 7

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

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