| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2011 | 19 | Yes |
Popular Name: (1S)-N-[(4-bromo-2-thienyl)methyl]-1-(2,4,5-trimethylphenyl)ethanamine (1S)-N-[(4-bromo-2-thienyl)methy…
| 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) | 5.29 | 10.35 | -41.7 | 2 | 1 | 1 | 17 | 339.322 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.29 | 9.2 | -3.01 | 1 | 1 | 0 | 12 | 338.314 | 4 | ↓ |
