UCSF

ZINC59817717

Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2011 44 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) 1.56 7.32 -62.71 7 12 1 186 603.652 14
Mid Mid (pH 6-8) 1.56 6.83 -23.04 6 12 0 184 602.644 14

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

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