In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 19 | Yes |
Popular Name: MFCD12027538 MFCD12027538
Find On: PubMed — Wikipedia — Google
CAS Number: 1142214-80-9
3-[(4-Acetylpiperazin-1-yl)carbonyl]-2,2-dimethylcyclopropanecarboxylic acid
3-[(4-acetylpiperazin-1-yl)carbonyl]-2,2-dimethylcyclopropanecarboxylicacid
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) | -0.17 | 5.73 | -56.66 | 0 | 6 | -1 | 81 | 267.305 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.17 | 3.73 | -15.84 | 1 | 6 | 0 | 78 | 268.313 | 2 | ↓ |
Note Type | Comments | Provided By |
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Warnings | IRRITANT | Matrix Scientific |