UCSF

ZINC86860029

Substance Information

In ZINC since Heavy atoms Benign functionality
March 12th, 2013 12 No

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Annotations

None

Vendors

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) 0.28 0.54 -8.13 2 3 0 58 280.061 1
Mid Mid (pH 6-8) 0.28 1.29 -50.4 1 3 -1 60 279.053 1

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

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