| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 10th, 2009 | 17 | Yes |
Popular Name: n-methyl-2-(4-methylpiperazin-1-yl)-1-phenylethanamine n-methyl-2-(4-methylpiperazin-1-…
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CAS Number: 885950-68-5
| 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) | 1.67 | 4.84 | -92.96 | 4 | 3 | 2 | 35 | 235.375 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 2.49 | -40.11 | 3 | 3 | 1 | 34 | 234.367 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 4.62 | -32.16 | 3 | 3 | 1 | 34 | 234.367 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 2.27 | -1.87 | 2 | 3 | 0 | 32 | 233.359 | 3 | ↓ |
