| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 19 | Yes |
Popular Name: (3S)-3-(aminomethyl)-1-isopropyl-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-3-amine (3S)-3-(aminomethyl)-1-isopropyl…
| 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) | -0.18 | 5.01 | -104.63 | 4 | 5 | 2 | 53 | 267.421 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.18 | 1.48 | -48.18 | 3 | 5 | 1 | 52 | 266.413 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.18 | 3.12 | -36.17 | 3 | 5 | 1 | 52 | 266.413 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.18 | 3.46 | -109.04 | 4 | 5 | 2 | 53 | 267.421 | 5 | ↓ |
