| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 11 | Yes |
Popular Name: Piperazine, 1-methyl-4-(2-methylpropyl)- (9CI) Piperazine, 1-methyl-4-(2-methyl…
Find On: PubMed — Wikipedia — Google
CAS Number: 21043-38-9
| 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) | 1.36 | 4.23 | -30.23 | 1 | 2 | 1 | 8 | 157.281 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.36 | 2.25 | -1.08 | 0 | 2 | 0 | 6 | 156.273 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.36 | 4.62 | -31.78 | 1 | 2 | 1 | 8 | 157.281 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4003913; US4041169; US4056537; US4056538; US4066779; US4066780; US4118394 | IBM Patent Data |
