UCSF

ZINC71613321

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2011 22 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) 1.35 8.06 -29.19 3 6 0 118 304.346 7
Mid Mid (pH 6-8) 1.35 7.74 -51.56 2 6 -1 116 303.338 7

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

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