In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 20 | Yes |
Popular Name: 1-[[[(1R)-1-(2-fluorophenyl)ethyl]amino]methyl]-N,N-dimethyl-cyclohexan-1-amine 1-[[[(1R)-1-(2-fluorophenyl)ethy…
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) | 4.18 | 8.94 | -33.6 | 2 | 2 | 1 | 16 | 279.423 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.18 | 8.16 | -36.17 | 2 | 2 | 1 | 20 | 279.423 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.