In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 6th, 2009 | 35 | Yes |
Popular Name: 2-[4-(2-anilino-2-oxo-ethyl)piperazin-1-yl]-N-(2-benzoyl-4-chloro-phenyl)acetamide 2-[4-(2-anilino-2-oxo-ethyl)pipe…
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) | 4.64 | 10.6 | -50.13 | 3 | 7 | 1 | 83 | 491.999 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.64 | 10.6 | -48.54 | 3 | 7 | 1 | 83 | 491.999 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.64 | 8.36 | -15.34 | 2 | 7 | 0 | 82 | 490.991 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.64 | 12.87 | -132.81 | 4 | 7 | 2 | 84 | 493.007 | 8 | ↓ |