UCSF

ZINC57218449

Substance Information

In ZINC since Heavy atoms Benign functionality
January 17th, 2011 12 No

Other Names:

MFCD16622161

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) -0.52 0.52 -9.59 2 3 0 38 186.28 1
Lo Low (pH 4.5-6) -0.52 2.78 -45.51 3 3 1 40 187.288 1

Vendor Notes

Note Type Comments Provided By
MP 146 - 148 Enamine Building Blocks
MP 146...148 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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