| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2010 | 18 | No |
Popular Name: 3-[[[(3S)-1-cyclopropylpyrrolidin-3-yl]amino]methyl]benzene-1,2-diol 3-[[[(3S)-1-cyclopropylpyrrolidi…
| 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) | 1.25 | 0.99 | -41.29 | 4 | 4 | 1 | 60 | 249.334 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 1.91 | -33.61 | 3 | 4 | 0 | 63 | 248.326 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.25 | 3.41 | -110.72 | 5 | 4 | 2 | 61 | 250.342 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.25 | 2.21 | -34.25 | 4 | 4 | 1 | 57 | 249.334 | 4 | ↓ |
