In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 18 | Yes |
Popular Name: 4-(aminomethyl)-N,1-dimethyl-N-(4-pyridylmethyl)piperidin-4-amine 4-(aminomethyl)-N,1-dimethyl-N-(…
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) | -0.25 | 2.69 | -132.34 | 4 | 4 | 2 | 48 | 250.39 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.25 | 2.86 | -38.96 | 3 | 4 | 1 | 47 | 249.382 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.25 | 3.21 | -112.01 | 4 | 4 | 2 | 48 | 250.39 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.25 | 0.84 | -45.34 | 3 | 4 | 1 | 47 | 249.382 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.25 | 3.67 | -169.44 | 5 | 4 | 3 | 49 | 251.398 | 4 | ↓ |