In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 17 | Yes |
Popular Name: (1S)-3-(4-methylpiperazin-1-yl)-1-phenyl-propan-1-amine (1S)-3-(4-methylpiperazin-1-yl)-…
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) | -0.38 | 4.37 | -33.32 | 3 | 3 | 1 | 34 | 234.367 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.38 | 4.74 | -122.16 | 4 | 3 | 2 | 35 | 235.375 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.38 | 2.39 | -48.31 | 3 | 3 | 1 | 34 | 234.367 | 4 | ↓ |