| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 19 | Yes |
Popular Name: (2S)-3-(4-benzyl-1,4-diazepan-1-yl)-2-methyl-propan-1-amine (2S)-3-(4-benzyl-1,4-diazepan-1-…
| 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) | 1.45 | 4.8 | -43.21 | 3 | 3 | 1 | 34 | 262.421 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.45 | 8.3 | -199.15 | 5 | 3 | 3 | 37 | 264.437 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.45 | 6.48 | -104.87 | 4 | 3 | 2 | 35 | 263.429 | 5 | ↓ |
