| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 20 | Yes |
Popular Name: 2-[4-[[(3S)-1-isopropylpyrrolidin-3-yl]amino]-1-piperidyl]-N-methyl-acetamide 2-[4-[[(3S)-1-isopropylpyrrolidi…
| 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) | 0.95 | 5.66 | -194.94 | 5 | 5 | 3 | 55 | 285.456 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.95 | -0.08 | -8.34 | 2 | 5 | 0 | 48 | 282.432 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.95 | 1.08 | -40.93 | 3 | 5 | 1 | 52 | 283.44 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.95 | 3.5 | -112.47 | 4 | 5 | 2 | 53 | 284.448 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.95 | 4.52 | -83.7 | 4 | 5 | 2 | 50 | 284.448 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.95 | 2.34 | -37.19 | 3 | 5 | 1 | 49 | 283.44 | 5 | ↓ |
