In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 20 | Yes |
Popular Name: 4-(aminomethyl)-N-methyl-1-propyl-N-(3-pyridylmethyl)piperidin-4-amine 4-(aminomethyl)-N-methyl-1-propy…
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) | 0.68 | 4.24 | -128.68 | 4 | 4 | 2 | 48 | 278.444 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.68 | 4.26 | -37.52 | 3 | 4 | 1 | 47 | 277.436 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.68 | 4.6 | -111.86 | 4 | 4 | 2 | 48 | 278.444 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.68 | 2.39 | -44.04 | 3 | 4 | 1 | 47 | 277.436 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.68 | 5.07 | -176.77 | 5 | 4 | 3 | 49 | 279.452 | 6 | ↓ |