In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 12th, 2011 | 23 | Yes |
Popular Name: (3S,5R)-N,N-diethyl-5-(4-fluorophenyl)-2-methyl-1,1-dioxo-1,2,6-thiadiazinane-3-carboxamide (3S,5R)-N,N-diethyl-5-(4-fluorop…
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) | 1.45 | 3.58 | -14.49 | 1 | 6 | 0 | 70 | 343.424 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.45 | 3.29 | -43.02 | 0 | 6 | -1 | 72 | 342.416 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.