| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 17 | Yes |
Popular Name: (1R)-N-methyl-N-[(3-methyl-2-thienyl)methyl]-1-(2-pyridyl)ethanamine (1R)-N-methyl-N-[(3-methyl-2-thi…
| 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) | 2.80 | 6.54 | -5.75 | 0 | 2 | 0 | 16 | 246.379 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 8.76 | -31.73 | 1 | 2 | 1 | 17 | 247.387 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 6.74 | -31.43 | 1 | 2 | 1 | 17 | 247.387 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
