| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2010 | 19 | Yes |
Popular Name: (3S)-N-[(1R)-1-(3-bromo-4-fluoro-phenyl)ethyl]-1-cyclopropyl-pyrrolidin-3-amine (3S)-N-[(1R)-1-(3-bromo-4-fluoro…
| 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) | 3.47 | 8.5 | -36.72 | 2 | 2 | 1 | 16 | 328.249 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.47 | 6.09 | -3.7 | 1 | 2 | 0 | 15 | 327.241 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.47 | 7.09 | -47.06 | 2 | 2 | 1 | 20 | 328.249 | 4 | ↓ |
