In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2008 | 25 | Yes |
Popular Name: N-[3-(4-methylpiperazin-1-yl)propyl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide N-[3-(4-methylpiperazin-1-yl)pro…
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) | 1.03 | 4.51 | -46.19 | 2 | 7 | 1 | 66 | 347.439 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.03 | 2.13 | -13.42 | 1 | 7 | 0 | 65 | 346.431 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.03 | 4.4 | -48.39 | 2 | 7 | 1 | 66 | 347.439 | 6 | ↓ |