In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 18 | Yes |
Popular Name: (2,5-dichlorophenyl)-(4-methyl-1,4-diazepan-1-yl)methanone (2,5-dichlorophenyl)-(4-methyl-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) | 2.35 | 8.53 | -39.6 | 1 | 3 | 1 | 25 | 288.198 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.35 | 6.52 | -7.55 | 0 | 3 | 0 | 24 | 287.19 | 1 | ↓ |