In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 25 | Yes |
Popular Name: [4-(2-hydroxy-4-methoxy-benzoyl)piperazin-1-yl]-(5-methyl-2-furyl)methanone [4-(2-hydroxy-4-methoxy-benzoyl)…
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) | 1.83 | 4.57 | -16.28 | 1 | 7 | 0 | 83 | 344.367 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.83 | 5.49 | -55.36 | 0 | 7 | -1 | 86 | 343.359 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.