In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 18th, 2008 | 22 | No |
Popular Name: 1-(4-ethyl-6-hydroxy-5-methyl-pyrimidin-2-yl)-3-(2-thienylsulfonyl)urea 1-(4-ethyl-6-hydroxy-5-methyl-py…
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) | 1.58 | 2.03 | -41.45 | 2 | 8 | -1 | 127 | 341.394 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.04 | 1.9 | -115.02 | 1 | 8 | -2 | 130 | 340.386 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.58 | 1.08 | -15.17 | 3 | 8 | 0 | 125 | 342.402 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.