| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2010 | 20 | Yes |
Popular Name: 2-bromo-4-[[[(3S)-1-cyclopropylpyrrolidin-3-yl]amino]methyl]-6-methoxy-phenol 2-bromo-4-[[[(3S)-1-cyclopropylp…
| 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) | 2.32 | 4.87 | -37.64 | 3 | 4 | 1 | 46 | 342.257 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.32 | 5.79 | -63.37 | 2 | 4 | 0 | 49 | 341.249 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.32 | 6.98 | -124.33 | 3 | 4 | 1 | 53 | 342.257 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.32 | 4.58 | -61.8 | 2 | 4 | 0 | 52 | 341.249 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.32 | 2.47 | -5.68 | 2 | 4 | 0 | 45 | 341.249 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.32 | 3.66 | -49.29 | 3 | 4 | 1 | 49 | 342.257 | 5 | ↓ |
