In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 21 | Yes |
Popular Name: 2-methyl-1-[4-[(1-propyl-4-piperidyl)amino]-1-piperidyl]propan-1-one 2-methyl-1-[4-[(1-propyl-4-piper…
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) | 2.26 | 7.34 | -41.71 | 2 | 4 | 1 | 37 | 296.479 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.26 | 6.13 | -47.99 | 2 | 4 | 1 | 40 | 296.479 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.26 | 8.36 | -119.34 | 3 | 4 | 2 | 41 | 297.487 | 5 | ↓ |