| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 16 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-butyl-1-isopropyl-N-methyl-pyrrolidin-3-amine (3S)-3-(aminomethyl)-N-butyl-1-i…
| 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) | 1.48 | 3.17 | -28.65 | 3 | 3 | 1 | 34 | 228.404 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.48 | 1.78 | -40.69 | 3 | 3 | 1 | 34 | 228.404 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.48 | 3.87 | -29.76 | 3 | 3 | 1 | 34 | 228.404 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.48 | 4.25 | -102.61 | 4 | 3 | 2 | 35 | 229.412 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.48 | 3.62 | -118.89 | 4 | 3 | 2 | 35 | 229.412 | 6 | ↓ |
