In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 8th, 2011 | 27 | No |
Popular Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-6-(p-tolylmethylsulfanyl)-2,4-dihydro-1H-1,3,5-triazine 3-[2-(3,4-dimethoxyphenyl)ethyl]…
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) | 3.89 | 9.26 | -36.41 | 2 | 5 | 1 | 48 | 386.541 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.89 | 8.28 | -9.29 | 1 | 5 | 0 | 46 | 385.533 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.