| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 17 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-(1-ethylpropyl)-1-isopropyl-N-methyl-pyrrolidin-3-amine (3S)-3-(aminomethyl)-N-(1-ethylp…
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|
| Hi High (pH 8-9.5) | 1.78 | 3.81 | -41.59 | 3 | 3 | 1 | 34 | 242.431 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.78 | 3.39 | -27.97 | 3 | 3 | 1 | 34 | 242.431 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.78 | 6 | -89.71 | 4 | 3 | 2 | 35 | 243.439 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.78 | 5.58 | -116.78 | 4 | 3 | 2 | 35 | 243.439 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.78 | 5.14 | -26.05 | 3 | 3 | 1 | 34 | 242.431 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.78 | 6.45 | -212.84 | 5 | 3 | 3 | 37 | 244.447 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.78 | 3.61 | -106.62 | 4 | 3 | 2 | 35 | 243.439 | 6 | ↓ |
