In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 21 | Yes |
Popular Name: N-(5-benzyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)methanesulfonamide N-(5-benzyl-6,7-dihydro-4H-thiaz…
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) | 1.95 | 5.44 | -57.08 | 1 | 5 | 0 | 66 | 323.443 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.95 | 3.16 | -46.71 | 0 | 5 | -1 | 64 | 322.435 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.87 | 3.71 | -11.99 | 1 | 5 | 0 | 66 | 323.443 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.87 | 6.01 | -55.39 | 2 | 5 | 1 | 67 | 324.451 | 3 | ↓ |