In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2009 | 27 | Yes |
Popular Name: 4-[2-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]-2-oxo-ethyl]-1,4-benzoxazin-3-one 4-[2-[(2S)-4-methyl-2-phenyl-pip…
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) | 2.06 | 6.96 | -14.37 | 0 | 6 | 0 | 53 | 365.433 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.06 | 9.36 | -55.97 | 1 | 6 | 1 | 54 | 366.441 | 3 | ↓ |