| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 19 | Yes |
Popular Name: (1S)-N-[(4-bromo-2-thienyl)methyl]-3-methyl-1-phenyl-butan-1-amine (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) | 4.47 | 10.42 | -42.47 | 2 | 1 | 1 | 17 | 339.322 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.47 | 10.51 | -2.22 | 1 | 1 | 0 | 12 | 338.314 | 6 | ↓ |
