In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 27 | Yes |
Popular Name: 2-[4-(2-anilino-2-oxo-ethyl)piperazin-1-yl]-N-cyclopropyl-N-isobutyl-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) | 2.24 | 8.31 | -40.95 | 2 | 6 | 1 | 57 | 373.521 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 6.25 | -11.87 | 1 | 6 | 0 | 56 | 372.513 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 8.47 | -40.06 | 2 | 6 | 1 | 57 | 373.521 | 8 | ↓ |