In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 22nd, 2009 | 20 | Yes |
Popular Name: 3-butyl-2-(dimethylaminomethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one 3-butyl-2-(dimethylaminomethyl)-…
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) | 2.76 | 9.97 | -51.3 | 1 | 4 | 1 | 39 | 294.444 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.76 | 7.54 | -11.03 | 0 | 4 | 0 | 38 | 293.436 | 5 | ↓ |