In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 3rd, 2008 | 30 | Yes |
Popular Name: N-[(2S)-4-(2-dimethylaminoethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]-3,4-dimethoxy-benzamide N-[(2S)-4-(2-dimethylaminoethyl)…
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) | 2.14 | 7.55 | -55.32 | 2 | 8 | 1 | 82 | 414.482 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.14 | 5.07 | -14.21 | 1 | 8 | 0 | 80 | 413.474 | 7 | ↓ |