In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2008 | 30 | No |
Popular Name: 2-[4-[2-(3-oxopiperazin-1-yl)acetyl]piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide 2-[4-[2-(3-oxopiperazin-1-yl)ace…
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) | 1.07 | 4.06 | -59.82 | 3 | 8 | 1 | 86 | 428.435 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.07 | 4.02 | -62.26 | 3 | 8 | 1 | 86 | 428.435 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.07 | 1.86 | -22.71 | 2 | 8 | 0 | 85 | 427.427 | 6 | ↓ |