| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 26th, 2010 | 17 | Yes |
Popular Name: (1S)-N-[(2,5-dimethylphenyl)methyl]-1-(2-thienyl)ethanamine (1S)-N-[(2,5-dimethylphenyl)meth…
| 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) | 4.18 | 9.12 | -37.38 | 2 | 1 | 1 | 17 | 246.399 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.18 | 7.93 | -3.65 | 1 | 1 | 0 | 12 | 245.391 | 4 | ↓ |
