| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 21 | Yes |
Popular Name: (1R,2S)-N1-[(3-bromophenyl)methyl]-N1-methyl-1-(p-tolyl)propane-1,2-diamine (1R,2S)-N1-[(3-bromophenyl)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) | 3.76 | 8.46 | -41.17 | 3 | 2 | 1 | 31 | 348.308 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.76 | 10.11 | -127.2 | 4 | 2 | 2 | 32 | 349.316 | 5 | ↓ |
