In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 3rd, 2008 | 27 | Yes |
Popular Name: 4-bromo-N-[(2S)-4-(2-dimethylaminoethyl)-2-methyl-3-oxo-1,4-benzoxazin-7-yl]benzamide 4-bromo-N-[(2S)-4-(2-dimethylami…
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) | 3.30 | 8.96 | -51.2 | 2 | 6 | 1 | 63 | 433.326 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.30 | 6.48 | -12.81 | 1 | 6 | 0 | 62 | 432.318 | 5 | ↓ |