UCSF

ZINC02579888

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 14 Yes

Popular Name: 4-(4-Iodophenyl)-4-oxobutyric acid 4-(4-Iodophenyl)-4-oxobutyric acid

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CAS Number: 194146-02-6

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) 2.33 0.34 -44.71 0 3 -1 57 303.075 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 175 - 177 Enamine Building Blocks
MP 175...177 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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