In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2011 | 16 | Yes |
Popular Name: 2-(4-tert-butylpiperazin-1-yl)-1-cyclopropyl-ethanone 2-(4-tert-butylpiperazin-1-yl)-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) | 1.46 | 6.06 | -31.46 | 1 | 3 | 1 | 25 | 225.356 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.46 | 3.92 | -5.4 | 0 | 3 | 0 | 24 | 224.348 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.