In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | Yes |
Popular Name: [4-(4-ethyl-1-piperidyl)-1-methyl-4-piperidyl]methanamine [4-(4-ethyl-1-piperidyl)-1-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) | 1.47 | 3.56 | -27.32 | 3 | 3 | 1 | 34 | 240.415 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.47 | 3.83 | -35.17 | 3 | 3 | 1 | 34 | 240.415 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 5.96 | -94.07 | 4 | 3 | 2 | 35 | 241.423 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 4.03 | -120.32 | 4 | 3 | 2 | 35 | 241.423 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.47 | 6.43 | -215.29 | 5 | 3 | 3 | 37 | 242.431 | 3 | ↓ |