In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2004 | 27 | Yes |
Popular Name: 2-[[[4-keto-5-(p-tolyl)-1H-thieno[2,3-d]pyrimidin-2-yl]thio]methyl]benzonitrile 2-[[[4-keto-5-(p-tolyl)-1H-thien…
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) | 5.69 | 10.92 | -21.17 | 1 | 4 | 0 | 70 | 389.505 | 4 | ↓ |
Mid Mid (pH 6-8) | 6.15 | 9.68 | -55.42 | 0 | 4 | -1 | 73 | 388.497 | 4 | ↓ |