In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 15 | Yes |
Popular Name: (1R,3R)-3-methyl-1-(6-methyl-3-pyridyl)cyclohexanamine (1R,3R)-3-methyl-1-(6-methyl-3-p…
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) | 2.12 | 5.12 | -45.11 | 3 | 2 | 1 | 41 | 205.325 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.12 | 4.86 | -3.94 | 2 | 2 | 0 | 39 | 204.317 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.12 | 5.56 | -100.32 | 4 | 2 | 2 | 42 | 206.333 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.