In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2009 | 23 | No |
Popular Name: 6,6-dimethyl-1-[2-(2,4,5-trichlorophenoxy)ethoxy]-1,3,5-triazine-2,4-diamine 6,6-dimethyl-1-[2-(2,4,5-trichlo…
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) | 2.06 | 8.26 | -31.15 | 5 | 7 | 1 | 100 | 381.671 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.19 | 8.29 | -14.81 | 4 | 7 | 0 | 96 | 380.663 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.