In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 25th, 2010 | 21 | Yes |
Popular Name: (1S,2S)-1-(m-tolyl)-1-(4-propylpiperazin-1-yl)butan-2-amine (1S,2S)-1-(m-tolyl)-1-(4-propylp…
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) | 2.86 | 8.04 | -95.9 | 4 | 3 | 2 | 35 | 291.483 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.86 | 5.78 | -40.41 | 3 | 3 | 1 | 34 | 290.475 | 6 | ↓ |