| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 5th, 2008 | 13 | Yes |
Popular Name: Piperazine, 1-methyl-4-(1H-pyrrol-2-ylmethyl)- (9CI) Piperazine, 1-methyl-4-(1H-pyrro…
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CAS Number: 416887-10-0
| 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) | 0.79 | 3.7 | -36.31 | 2 | 3 | 1 | 23 | 180.275 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.79 | 3.55 | -36.64 | 2 | 3 | 1 | 23 | 180.275 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.79 | 1.22 | -4.52 | 1 | 3 | 0 | 22 | 179.267 | 2 | ↓ |
