In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 17 | Yes |
Popular Name: 2,2-dimethyl-3-[(4-methylpiperazin-1-yl)carbonyl]cyclopropanecarboxylic acid 2,2-dimethyl-3-[(4-methylpiperaz…
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CAS Numbers: 1142214-55-8 , [1142214-55-8]
2,2-dimethyl-3-(4-methylpiperazine-1-carbonyl)cyclopropane-1-carboxylic acid
2,2-Dimethyl-3-[(4-methylpiperazin-1-yl)carbonyl]-cyclopropanecarboxylic acid
2,2-dimethyl-3-[(4-methylpiperazin-1-yl)carbonyl]-cyclopropanecarboxylicacid
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) | 0.47 | 4.35 | -54.95 | 0 | 5 | -1 | 64 | 239.295 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.47 | 6.7 | -72.66 | 1 | 5 | 0 | 65 | 240.303 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.47 | 4.95 | -45.77 | 2 | 5 | 1 | 62 | 241.311 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Warnings | IRRITANT | Matrix Scientific |