In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 26 | No |
Popular Name: 8-[2-(4-isopropyl-3-methyl-phenoxy)acetyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione 8-[2-(4-isopropyl-3-methyl-pheno…
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) | 1.84 | 5.24 | -17.6 | 2 | 7 | 0 | 88 | 359.426 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.02 | 2.6 | -48.16 | 1 | 7 | -1 | 94 | 358.418 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.