| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2008 | 21 | Yes |
Popular Name: (1S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(5-methyl-2-thienyl)ethanamine (1S)-N-[2-(3,4-dimethoxyphenyl)e…
| 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) | 3.63 | 8.79 | -47.56 | 2 | 3 | 1 | 35 | 306.451 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.63 | 7.48 | -7.06 | 1 | 3 | 0 | 30 | 305.443 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
