UCSF

ZINC36222237

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 12 Yes

Other Names:

MFCD14540395

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) 1.76 5 -7.06 2 3 0 43 181.626 0
Mid Mid (pH 6-8) 1.76 5.44 -25.63 3 3 1 45 182.634 0

Vendor Notes

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

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