In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2009 | 26 | Yes |
Popular Name: 4-[2-(4-cyclopentylpiperazin-1-yl)-2-oxo-ethyl]-6-methyl-1,4-benzoxazin-3-one 4-[2-(4-cyclopentylpiperazin-1-y…
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 | 6.85 | -14.61 | 0 | 6 | 0 | 53 | 357.454 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.30 | 9.2 | -49.14 | 1 | 6 | 1 | 54 | 358.462 | 3 | ↓ |