UCSF

ZINC59211271

Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2011 40 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) -0.84 5 -93.53 4 16 0 211 607.704 13
Mid Mid (pH 6-8) -0.84 2.53 -68.36 3 16 -1 210 606.696 13

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

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