In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 28 | No |
Popular Name: N'-(4-methyl-3-oxo-1,4-benzoxazin-6-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]oxamide N'-(4-methyl-3-oxo-1,4-benzoxazi…
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) | -0.32 | 2.33 | -43.32 | 3 | 9 | 1 | 95 | 390.464 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.32 | -0.04 | -10.61 | 2 | 9 | 0 | 94 | 389.456 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.32 | 2.23 | -47.23 | 3 | 9 | 1 | 95 | 390.464 | 6 | ↓ |