UCSF

ZINC23042741

Substance Information

In ZINC since Heavy atoms Benign functionality
December 24th, 2008 21 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) 0.24 1.36 -12.98 1 8 0 89 293.279 5
Hi High (pH 8-9.5) 0.43 -0.44 -44.87 0 8 -1 96 292.271 5

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

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