| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2010 | 18 | Yes |
Popular Name: 2-bromo-6-[[[(3R)-1-cyclopropylpyrrolidin-3-yl]amino]methyl]phenol 2-bromo-6-[[[(3R)-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 | 4.87 | -33.15 | 3 | 3 | 1 | 37 | 312.231 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.51 | 5.6 | -48.23 | 2 | 3 | 0 | 40 | 311.223 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.50 | 6.93 | -78.5 | 3 | 3 | 1 | 44 | 312.231 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.50 | 4.59 | -29.59 | 2 | 3 | 0 | 43 | 311.223 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.50 | 2.53 | -3.61 | 2 | 3 | 0 | 35 | 311.223 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.51 | 3.75 | -41.68 | 3 | 3 | 1 | 40 | 312.231 | 4 | ↓ |
