UCSF

ZINC57921561

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2011 28 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) -0.44 1.97 -39.83 4 10 1 121 398.484 8
Mid Mid (pH 6-8) -0.44 -0.21 -17.3 3 10 0 120 397.476 8

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

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