In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 18 | Yes |
Popular Name: [4-(2-aminoethyl)-1-piperidyl]-(3-hydroxy-2-pyridyl)methanone [4-(2-aminoethyl)-1-piperidyl]-(…
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) | 0.36 | 3.64 | -86.63 | 3 | 5 | 0 | 84 | 249.314 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.36 | 2.64 | -53.41 | 4 | 5 | 1 | 81 | 250.322 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.36 | 1.66 | -73.93 | 4 | 5 | 1 | 85 | 250.322 | 3 | ↓ |