| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 19 | Yes |
Popular Name: 4-[(1S)-1-[[(3S)-1-isopropylpyrrolidin-3-yl]amino]ethyl]benzonitrile 4-[(1S)-1-[[(3S)-1-isopropylpyrr…
| 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) | 2.63 | 8.05 | -37.42 | 2 | 3 | 1 | 40 | 258.389 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.63 | 5.72 | -4.53 | 1 | 3 | 0 | 39 | 257.381 | 4 | ↓ |
