In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 25 | Yes |
Popular Name: 3-chloro-N-(5-propyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)benzothiophene-2-carboxamide 3-chloro-N-(5-propyl-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) | 4.90 | 8.54 | -13.4 | 1 | 4 | 0 | 45 | 391.949 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.96 | 7.26 | -48.3 | 0 | 4 | -1 | 52 | 390.941 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.82 | 10.01 | -53.48 | 2 | 4 | 1 | 50 | 392.957 | 3 | ↓ |