In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2008 | 24 | Yes |
Popular Name: 3-chloro-N-(5-ethyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)benzothiophene-2-carboxamide 3-chloro-N-(5-ethyl-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) | 4.39 | 7.78 | -13.61 | 1 | 4 | 0 | 45 | 377.922 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.46 | 6.52 | -48.46 | 0 | 4 | -1 | 52 | 376.914 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.39 | 10.06 | -46.17 | 2 | 4 | 1 | 46 | 378.93 | 3 | ↓ |