UCSF

ZINC42163765

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2010 21 Yes

Other Names:

MFCD19982492

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) 0.80 5.75 -49.73 1 6 -1 89 286.311 4
Mid Mid (pH 6-8) 1.26 5.1 -61.92 1 6 -1 93 286.311 4

Vendor Notes

Note Type Comments Provided By
MP 197 - 199 Enamine Building Blocks
MP 197...199 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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