UCSF

ZINC59211208

Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2011 41 No

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Annotations

Vendors

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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) 2.72 11.31 -27.83 3 11 0 149 588.671 10
Hi High (pH 8-9.5) 2.90 9.62 -65.62 2 11 -1 155 587.663 10

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

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