In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2011 | 23 | No |
Popular Name: 1-(6-chloro-2,3-dihydro-1,4-benzothiazin-4-yl)-2-(2-methyl-4-nitro-imidazol-1-yl)ethanone 1-(6-chloro-2,3-dihydro-1,4-benz…
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) | 2.11 | 10.48 | -26.47 | 0 | 7 | 0 | 84 | 352.803 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.11 | 10.91 | -51.97 | 1 | 7 | 1 | 85 | 353.811 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.