| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 26th, 2011 | 26 | Yes |
Popular Name: [4-(3-chlorobenzoyl)-1,4-diazepan-1-yl]-(2-hydroxy-4-methyl-phenyl)methanone [4-(3-chlorobenzoyl)-1,4-diazepa…
None
None
| 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) | 3.19 | 8.03 | -14.86 | 1 | 5 | 0 | 61 | 372.852 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.19 | 8.86 | -55.67 | 0 | 5 | -1 | 64 | 371.844 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
