In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 27 | Yes |
Popular Name: 2,3,5-trimethyl-6-[4-(2-pyridyl)piperazine-1-carbonyl]thieno[2,3-d]pyrimidin-4-one 2,3,5-trimethyl-6-[4-(2-pyridyl)…
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) | 1.64 | 7.66 | -45.23 | 1 | 7 | 1 | 73 | 384.485 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 7.38 | -18.8 | 0 | 7 | 0 | 71 | 383.477 | 2 | ↓ |