In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2008 | 25 | Yes |
Popular Name: 1-(4-methylpiperazin-1-yl)-3-[(3R)-1-(3-methylthiophene-2-carbonyl)-3-piperidyl]propan-1-one 1-(4-methylpiperazin-1-yl)-3-[(3…
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) | 2.21 | -0.18 | -44.68 | 1 | 5 | 1 | 45 | 364.535 | 4 | ↓ |