| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2010 | 21 | Yes |
Popular Name: 4-[4-[(1S)-3-amino-1-ethyl-propyl]-1,4-diazepan-1-yl]-N,N-dimethyl-butanamide 4-[4-[(1S)-3-amino-1-ethyl-propy…
| 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) | -0.10 | 5.13 | -101.17 | 4 | 5 | 2 | 56 | 300.491 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.10 | 4.31 | -36.09 | 3 | 5 | 1 | 54 | 299.483 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.10 | 3.32 | -49.94 | 3 | 5 | 1 | 54 | 299.483 | 8 | ↓ |
| Mid Mid (pH 6-8) | -0.10 | 6.13 | -111.74 | 4 | 5 | 2 | 55 | 300.491 | 8 | ↓ |
| Mid Mid (pH 6-8) | -0.10 | 4.7 | -116.69 | 4 | 5 | 2 | 56 | 300.491 | 8 | ↓ |
| Lo Low (pH 4.5-6) | -0.10 | 6.51 | -213.06 | 5 | 5 | 3 | 57 | 301.499 | 8 | ↓ |
