In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 14 | No |
Popular Name: 4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-2-carbaldehyde-hydrazone 4-keto-5-methyl-3H-thieno[2,3-d]…
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) | 0.45 | 1.72 | -9.81 | 3 | 5 | 0 | 84 | 208.246 | 1 | ↓ |
Ref Reference (pH 7) | 0.45 | 0.96 | -11.47 | 3 | 5 | 0 | 84 | 208.246 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.90 | 0.62 | -39.47 | 2 | 5 | -1 | 87 | 207.238 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.45 | 0.39 | -20.74 | 3 | 5 | 0 | 84 | 208.246 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.90 | -0.87 | -47.33 | 2 | 5 | -1 | 87 | 207.238 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.45 | 1.54 | -16.6 | 3 | 5 | 0 | 84 | 208.246 | 1 | ↓ |