UCSF

ZINC54910666

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 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) 2.62 5.33 -6.14 1 3 0 36 284.45 1
Mid Mid (pH 6-8) 2.62 5.72 -28.03 2 3 1 38 285.458 1

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

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