UCSF

ZINC36162312

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 18 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) -0.40 3.14 -54.91 0 7 -1 95 272.306 2
Mid Mid (pH 6-8) -0.40 3.26 -49.83 1 7 0 97 273.314 2

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

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