In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 21 | Yes |
Popular Name: (2R)-3-methyl-2-(4-methylpiperazin-1-yl)-N-[(1S)-1-phenylethyl]butan-1-amine (2R)-3-methyl-2-(4-methylpiperaz…
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) | 3.09 | 6.59 | -36.32 | 2 | 3 | 1 | 23 | 290.475 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.09 | 8.39 | -32.28 | 2 | 3 | 1 | 20 | 290.475 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.09 | 8.6 | -93.85 | 3 | 3 | 2 | 24 | 291.483 | 6 | ↓ |