In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 25 | Yes |
Popular Name: 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide 2-[(2S,6R)-2,6-dimethylmorpholin…
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) | 1.49 | 2.32 | -21.89 | 1 | 7 | 0 | 89 | 383.495 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.31 | 1.38 | -49.78 | 0 | 7 | -1 | 95 | 382.487 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.49 | 4.52 | -57.4 | 2 | 7 | 1 | 90 | 384.503 | 4 | ↓ |