| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 20 | Yes |
Popular Name: [4-[(2R)-3-amino-2-methyl-propyl]-1,4-diazepan-1-yl]-(3-methyl-2-furyl)methanone [4-[(2R)-3-amino-2-methyl-propyl…
| 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) | 0.72 | 6.1 | -115.04 | 4 | 5 | 2 | 66 | 281.4 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.72 | 4.59 | -50.49 | 3 | 5 | 1 | 64 | 280.392 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.72 | 5.71 | -42.04 | 3 | 5 | 1 | 64 | 280.392 | 4 | ↓ |
