In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | Yes |
Popular Name: 2-methyl-2-(4-methylpiperazin-1-yl)-N-[(1R)-1-(1-methyl-4-piperidyl)ethyl]propan-1-amine 2-methyl-2-(4-methylpiperazin-1-…
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) | 1.96 | 7.94 | -162.55 | 4 | 4 | 3 | 29 | 299.527 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.96 | 7.53 | -188.03 | 4 | 4 | 3 | 29 | 299.527 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.96 | 5.58 | -94.82 | 3 | 4 | 2 | 28 | 298.519 | 5 | ↓ |