In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 25 | Yes |
Popular Name: (2R)-N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2R)-N-(3-cyano-4-ethyl-5-methyl…
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) | 2.75 | 5.87 | -10.64 | 2 | 6 | 0 | 91 | 355.419 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.94 | 4.5 | -41.58 | 1 | 6 | -1 | 98 | 354.411 | 3 | ↓ |