In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 19 | Yes |
Popular Name: (4-methyl-4-piperidyl)-[4-[(1R)-1-methylpropyl]piperazin-1-yl]methanone (4-methyl-4-piperidyl)-[4-[(1R)-…
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) | 1.22 | 6 | -94.46 | 3 | 4 | 2 | 41 | 269.433 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.22 | 4.21 | -40.86 | 2 | 4 | 1 | 40 | 268.425 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.