In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 19 | Yes |
Popular Name: 4-(1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)thieno[3,2-d]pyrimidine 4-(1-methyl-6,7-dihydro-4H-imida…
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) | 0.65 | 8.8 | -39.63 | 1 | 5 | 1 | 48 | 272.357 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.65 | 8.34 | -12.38 | 0 | 5 | 0 | 47 | 271.349 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.65 | 9.26 | -76.66 | 2 | 5 | 2 | 49 | 273.365 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.