| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 23 | Yes |
Popular Name: (3S)-N-(4-chlorophenyl)-3-[2-(diisopropylamino)ethylamino]butanamide (3S)-N-(4-chlorophenyl)-3-[2-(di…
| 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) | 4.78 | 6.68 | -39.96 | 3 | 4 | 1 | 49 | 340.919 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.78 | 7.5 | -29.56 | 3 | 4 | 1 | 46 | 340.919 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.78 | 5.5 | -7.41 | 2 | 4 | 0 | 44 | 339.911 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.78 | 8.77 | -105.98 | 4 | 4 | 2 | 50 | 341.927 | 9 | ↓ |
