In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 24 | Yes |
Popular Name: 5-(3-chlorophenyl)-4-methyl-N-(2-morpholinoethyl)-1,1-dioxo-isothiazol-3-amine 5-(3-chlorophenyl)-4-methyl-N-(2…
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) | 2.18 | 2.31 | -20.34 | 1 | 6 | 0 | 71 | 369.874 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.18 | 3.68 | -40.62 | 1 | 6 | 0 | 74 | 369.874 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.18 | 1.34 | -38.88 | 0 | 6 | -1 | 73 | 368.866 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.