| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 20 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-[(3-bromophenyl)methyl]-1-isopropyl-N-methyl-pyrrolidin-3-amine (3S)-3-(aminomethyl)-N-[(3-bromo…
| 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) | 2.22 | 6.3 | -112.75 | 4 | 3 | 2 | 35 | 342.325 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.22 | 4.3 | -51.42 | 3 | 3 | 1 | 34 | 341.317 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.22 | 5.66 | -33.41 | 3 | 3 | 1 | 34 | 341.317 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.22 | 8.35 | -238.15 | 5 | 3 | 3 | 37 | 343.333 | 5 | ↓ |
