| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 17 | Yes |
Popular Name: (3R)-3-[[(3S)-1-isopropylpyrrolidin-3-yl]amino]azepan-2-one (3R)-3-[[(3S)-1-isopropylpyrroli…
| 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) | 0.92 | 4.39 | -40.69 | 3 | 4 | 1 | 46 | 240.371 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 1.97 | -5.68 | 2 | 4 | 0 | 44 | 239.363 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.92 | 2.11 | -38.74 | 3 | 4 | 1 | 49 | 240.371 | 3 | ↓ |
