In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 16 | Yes |
Popular Name: 1-ethyl-3-(5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)urea 1-ethyl-3-(5-methyl-6,7-dihydro-…
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) | 1.20 | 1.16 | -8.77 | 2 | 5 | 0 | 57 | 240.332 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.20 | 3.89 | -47.76 | 3 | 5 | 1 | 58 | 241.34 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4289524 | IBM Patent Data |