In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 22 | Yes |
Popular Name: (2S)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2S)-N-(5-ethyl-1,3,4-thiadiazol…
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) | 1.23 | 4.79 | -21.11 | 2 | 7 | 0 | 93 | 318.358 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.41 | 2.04 | -59.91 | 1 | 7 | -1 | 100 | 317.35 | 3 | ↓ |