In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2010 | 17 | Yes |
Popular Name: (1S,2S)-2-(4-methylpiperazin-1-yl)-1-phenyl-propan-1-ol (1S,2S)-2-(4-methylpiperazin-1-y…
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) | 1.38 | 4.47 | -35.96 | 2 | 3 | 1 | 28 | 235.351 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.38 | 2.11 | -3.42 | 1 | 3 | 0 | 27 | 234.343 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.38 | 3.84 | -31.86 | 2 | 3 | 1 | 28 | 235.351 | 3 | ↓ |