In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 18th, 2011 | 20 | Yes |
Popular Name: 2-[[[(1S)-1-(2-furyl)ethyl]-methyl-amino]methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[[[(1S)-1-(2-furyl)ethyl]-meth…
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) | 2.33 | 4.12 | -44.83 | 1 | 5 | 0 | 66 | 289.36 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 4.54 | -14.13 | 1 | 5 | 0 | 62 | 289.36 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 6.82 | -49.81 | 2 | 5 | 1 | 63 | 290.368 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.