In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2008 | 23 | Yes |
Popular Name: 3-ethyl-N-(6-methyl-4,5-dihydropyrazolo[4,5-e][1,3]benzothiazol-2-yl)isoxazole-5-carboxamide 3-ethyl-N-(6-methyl-4,5-dihydrop…
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) | 2.15 | 6.33 | -19.18 | 1 | 7 | 0 | 86 | 329.385 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.22 | 5.23 | -51.41 | 0 | 7 | -1 | 92 | 328.377 | 3 | ↓ |