In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 20 | Yes |
Popular Name: 3-methoxy-N-(5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)thiophene-2-carboxamide 3-methoxy-N-(5-methyl-6,7-dihydr…
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) | 2.09 | 3.67 | -12.41 | 1 | 5 | 0 | 54 | 309.416 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.16 | 2.06 | -52.77 | 0 | 5 | -1 | 61 | 308.408 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.09 | 6.43 | -51 | 2 | 5 | 1 | 56 | 310.424 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.