UCSF

ZINC71789506

Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2012 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) 0.62 2.61 -18.96 5 5 0 83 163.184 1
Mid Mid (pH 6-8) 0.62 3.2 -41.89 6 5 1 84 164.192 1
Mid Mid (pH 6-8) 0.62 2.8 -37.38 4 5 -1 81 162.176 1
Mid Mid (pH 6-8) 0.62 3.31 -10.43 5 5 0 83 163.184 1

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

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