In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 21 | Yes |
Popular Name: 2-(dimethylamino)-1-[4-(4-methylpiperidine-4-carbonyl)piperazin-1-yl]ethanone 2-(dimethylamino)-1-[4-(4-methyl…
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) | -0.64 | 4.75 | -88.54 | 3 | 6 | 2 | 62 | 298.431 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.64 | 2.36 | -46.4 | 2 | 6 | 1 | 60 | 297.423 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.