In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 22nd, 2009 | 21 | Yes |
Popular Name: 2-(dimethylaminomethyl)-3-propyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one 2-(dimethylaminomethyl)-3-propyl…
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) | 2.78 | 10.44 | -50.84 | 1 | 4 | 1 | 39 | 306.455 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.78 | 8.01 | -11.15 | 0 | 4 | 0 | 38 | 305.447 | 4 | ↓ |