In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 22 | Yes |
Popular Name: 2-[[ethyl(m-tolylmethyl)amino]methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[[ethyl(m-tolylmethyl)amino]me…
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) | 3.31 | 6.58 | -44.97 | 1 | 4 | 0 | 53 | 313.426 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.85 | 9.28 | -49.61 | 2 | 4 | 1 | 50 | 314.434 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.