UCSF

ZINC12505167

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 15 No

Other Names:

MFCD08691155

Download: MOL2 SDF SMILES Flexibase

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) 0.08 5.36 -10.55 1 5 0 46 226.305 2
Mid Mid (pH 6-8) 0.81 5.2 -45.45 0 5 -1 43 225.297 2

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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