In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 11th, 2011 | 28 | Yes |
Popular Name: 9-[(2-benzyloxyphenyl)methyl]-5-methyl-2,5,9-triazaspiro[5.5]undecan-1-one 9-[(2-benzyloxyphenyl)methyl]-5-…
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) | 2.80 | 7.79 | -28.74 | 2 | 5 | 1 | 46 | 380.512 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.80 | 5.51 | -8.81 | 1 | 5 | 0 | 45 | 379.504 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.