| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 21 | Yes |
Popular Name: (3S)-3-(aminomethyl)-1-isopropyl-N-[(2-methoxyphenyl)methyl]-N-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) | 1.45 | 5.56 | -117.33 | 4 | 4 | 2 | 45 | 293.455 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 4.65 | -31.71 | 3 | 4 | 1 | 43 | 292.447 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 3.26 | -47.76 | 3 | 4 | 1 | 43 | 292.447 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 5.18 | -26.49 | 3 | 4 | 1 | 43 | 292.447 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 6.84 | -96.56 | 4 | 4 | 2 | 44 | 293.455 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 5.26 | -106.46 | 4 | 4 | 2 | 45 | 293.455 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.45 | 7.33 | -225.37 | 5 | 4 | 3 | 46 | 294.463 | 6 | ↓ |
