In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 22 | Yes |
Popular Name: 2,3,5-trimethyl-6-(4-methylpiperazine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one 2,3,5-trimethyl-6-(4-methylpiper…
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) | 0.85 | 4.51 | -15.61 | 0 | 6 | 0 | 58 | 320.418 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.85 | 6.91 | -53.03 | 1 | 6 | 1 | 60 | 321.426 | 1 | ↓ |