In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2011 | 24 | Yes |
Popular Name: 1-[[3-(azepan-1-ylmethyl)phenyl]methyl]-3-(2,2,2-trifluoroethyl)urea 1-[[3-(azepan-1-ylmethyl)phenyl]…
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) | 3.27 | 7.76 | -41.85 | 3 | 4 | 1 | 46 | 344.401 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.