In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 24 | No |
Popular Name: (4-methylsulfanyl-3-nitro-phenyl)-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone (4-methylsulfanyl-3-nitro-phenyl…
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) | 0.76 | 5.15 | -21.68 | 0 | 8 | 0 | 104 | 373.456 | 4 | ↓ |