In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2009 | 23 | No |
Popular Name: 1-[3-(2,5-dichlorophenyl)sulfanylpropoxy]-6,6-dimethyl-1,3,5-triazine-2,4-diamine 1-[3-(2,5-dichlorophenyl)sulfany…
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) | 2.10 | 9.95 | -30.66 | 5 | 6 | 1 | 91 | 377.321 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 9.99 | -14.79 | 4 | 6 | 0 | 87 | 376.313 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.