| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 21 | Yes |
Popular Name: (1R)-N-[(3-bromophenyl)methyl]-1-(4-isobutylphenyl)ethanamine (1R)-N-[(3-bromophenyl)methyl]-1…
| 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) | 5.54 | 12.17 | -42.53 | 2 | 1 | 1 | 17 | 347.32 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.54 | 11.07 | -3.21 | 1 | 1 | 0 | 12 | 346.312 | 6 | ↓ |
