In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2010 | 28 | Yes |
Popular Name: 6-[3-(4-benzylpiperazin-1-yl)-3-oxo-propyl]-4H-1,4-benzoxazin-3-one 6-[3-(4-benzylpiperazin-1-yl)-3-…
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) | 2.30 | 6.68 | -13.15 | 1 | 6 | 0 | 62 | 379.46 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.30 | 8.89 | -53.03 | 2 | 6 | 1 | 63 | 380.468 | 5 | ↓ |