In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 26 | Yes |
Popular Name: 4-(2,3-dihydro-1,4-benzoxazin-4-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-4-oxo-butanamide 4-(2,3-dihydro-1,4-benzoxazin-4-…
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) | 0.13 | 4.95 | -45.98 | 2 | 7 | 1 | 66 | 361.466 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.13 | 4.83 | -48.24 | 2 | 7 | 1 | 66 | 361.466 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.13 | 2.49 | -13.23 | 1 | 7 | 0 | 65 | 360.458 | 6 | ↓ |