In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 25 | Yes |
Popular Name: (2R)-N-(3-carbamoyl-5-ethyl-2-thienyl)-2-methyl-3-oxo-4H-1,4-benzothiazine-2-carboxamide (2R)-N-(3-carbamoyl-5-ethyl-2-th…
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) | 1.93 | 3.71 | -13.74 | 4 | 6 | 0 | 101 | 375.475 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.11 | 2.48 | -49.25 | 3 | 6 | -1 | 108 | 374.467 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.