In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 18 | Yes |
Popular Name: (4-allylpiperazin-1-yl)-(4-methyl-4-piperidyl)methanone (4-allylpiperazin-1-yl)-(4-methy…
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) | 0.65 | 3.21 | -41.43 | 2 | 4 | 1 | 40 | 252.382 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.65 | 5.46 | -92.68 | 3 | 4 | 2 | 41 | 253.39 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.