In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 18 | Yes |
Popular Name: 7-[(1R)-1-(3-pyridyl)ethyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine 7-[(1R)-1-(3-pyridyl)ethyl]-6,8-…
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) | 0.80 | 5.22 | -8.7 | 0 | 4 | 0 | 42 | 240.31 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.80 | 7.17 | -44.6 | 1 | 4 | 1 | 43 | 241.318 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.