In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 16 | Yes |
Popular Name: 2-[[2-aminoethyl(methyl)amino]methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[[2-aminoethyl(methyl)amino]me…
None
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) | -0.54 | -0.09 | -63.02 | 4 | 5 | 1 | 77 | 239.324 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.54 | 2.5 | -135.76 | 5 | 5 | 2 | 78 | 240.332 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.