In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 33 | Yes |
Popular Name: 4-[4-(4-benzylpiperazin-1-yl)-4-oxo-butyl]-6-tert-butyl-1,4-benzoxazin-3-one 4-[4-(4-benzylpiperazin-1-yl)-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) | 4.10 | 10.99 | -16.04 | 0 | 6 | 0 | 53 | 449.595 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.10 | 13.21 | -55.76 | 1 | 6 | 1 | 54 | 450.603 | 7 | ↓ |