In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2009 | 32 | Yes |
Popular Name: N-[2-oxo-2-[[6-(3-oxopiperazin-1-yl)-3-pyridyl]amino]ethyl]-4-phenyl-benzamide N-[2-oxo-2-[[6-(3-oxopiperazin-1…
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) | 2.94 | 5.03 | -18.79 | 3 | 8 | 0 | 103 | 429.48 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.94 | 5.29 | -54.92 | 4 | 8 | 1 | 105 | 430.488 | 6 | ↓ |