In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 18 | Yes |
Popular Name: [3-[(4-propylpiperazin-1-yl)methyl]phenyl]methanamine [3-[(4-propylpiperazin-1-yl)meth…
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) | 1.67 | 5.34 | -92.46 | 4 | 3 | 2 | 35 | 249.402 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.67 | 5.35 | -97.21 | 4 | 3 | 2 | 35 | 249.402 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.67 | 3.03 | -46.11 | 3 | 3 | 1 | 34 | 248.394 | 5 | ↓ |