| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 29th, 2008 | 22 | Yes |
Popular Name: 2-[(4-allyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[3,2-e]pyrimidin-4-one 2-[(4-allyl-1,2,4-triazol-3-yl)s…
| 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) | 2.13 | 9.07 | -15.13 | 1 | 6 | 0 | 76 | 333.442 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.58 | 8.09 | -49.99 | 0 | 6 | -1 | 80 | 332.434 | 5 | ↓ |
