| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2010 | 18 | Yes |
Popular Name: 2-bromo-6-[[[(3S)-1-cyclopropylpyrrolidin-3-yl]amino]methyl]phenol 2-bromo-6-[[[(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) | 2.50 | 4.97 | -32.87 | 3 | 3 | 1 | 37 | 312.231 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.51 | 5.7 | -45.94 | 2 | 3 | 0 | 40 | 311.223 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.50 | 7.01 | -78.26 | 3 | 3 | 1 | 44 | 312.231 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.50 | 4.61 | -29.07 | 2 | 3 | 0 | 43 | 311.223 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.50 | 2.57 | -3.46 | 2 | 3 | 0 | 35 | 311.223 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.51 | 3.76 | -41.65 | 3 | 3 | 1 | 40 | 312.231 | 4 | ↓ |
