| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 19 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N,N-diisobutyl-1-isopropyl-pyrrolidin-3-amine (3S)-3-(aminomethyl)-N,N-diisobu…
| 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) | 2.28 | 5.66 | -25.45 | 3 | 3 | 1 | 34 | 270.485 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.28 | 5.19 | -44.05 | 3 | 3 | 1 | 34 | 270.485 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.28 | 6.43 | -29.38 | 3 | 3 | 1 | 34 | 270.485 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.28 | 4.82 | -0.1 | 2 | 3 | 0 | 32 | 269.477 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.28 | 7.24 | -92.13 | 4 | 3 | 2 | 35 | 271.493 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.28 | 5.28 | -113.46 | 4 | 3 | 2 | 35 | 271.493 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.28 | 6.69 | -107.25 | 4 | 3 | 2 | 35 | 271.493 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.28 | 7.99 | -219.06 | 5 | 3 | 3 | 37 | 272.501 | 7 | ↓ |
