In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 16 | Yes |
Popular Name: 2-[(1-methyl-4-piperidyl)amino]-1-pyrrolidin-1-yl-ethanone 2-[(1-methyl-4-piperidyl)amino]-…
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) | 0.27 | 5.42 | -105.09 | 3 | 4 | 2 | 41 | 227.352 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.27 | 4.24 | -40.33 | 2 | 4 | 1 | 37 | 226.344 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.27 | 3.04 | -40.01 | 2 | 4 | 1 | 40 | 226.344 | 3 | ↓ |