| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 19 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-ethyl-N-(2-ethylbutyl)-1-isopropyl-pyrrolidin-3-amine (3S)-3-(aminomethyl)-N-ethyl-N-(…
| 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) | 2.54 | 4.61 | -29.47 | 3 | 3 | 1 | 34 | 270.485 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 3.44 | -40.68 | 3 | 3 | 1 | 34 | 270.485 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 6.35 | -30.68 | 3 | 3 | 1 | 34 | 270.485 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 6.95 | -96.16 | 4 | 3 | 2 | 35 | 271.493 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 4.94 | -119.19 | 4 | 3 | 2 | 35 | 271.493 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.54 | 7.38 | -225.95 | 5 | 3 | 3 | 37 | 272.501 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.54 | 5.99 | -106.33 | 4 | 3 | 2 | 35 | 271.493 | 8 | ↓ |
