| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 20 | Yes |
Popular Name: (2R)-2-methyl-1-[(4-methylsulfonylphenyl)methyl]-1,4-diazepan-5-one (2R)-2-methyl-1-[(4-methylsulfon…
| 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) | 0.18 | 0.94 | -16.56 | 1 | 5 | 0 | 66 | 296.392 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.18 | 2.88 | -58.26 | 2 | 5 | 1 | 68 | 297.4 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
