In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 28 | Yes |
Popular Name: 3-(3-oxo-1,4-benzoxazin-4-yl)-N-[3-(4-propylpiperazin-1-yl)propyl]propanamide 3-(3-oxo-1,4-benzoxazin-4-yl)-N-…
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) | 1.68 | 6.37 | -44.28 | 2 | 7 | 1 | 66 | 389.52 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.68 | 4.11 | -12.24 | 1 | 7 | 0 | 65 | 388.512 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.68 | 6.38 | -47.85 | 2 | 7 | 1 | 66 | 389.52 | 9 | ↓ |