In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 18 | Yes |
Popular Name: 2-methyl-7-[2-(2-thienyl)ethyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine 2-methyl-7-[2-(2-thienyl)ethyl]-…
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) | 1.87 | 8.3 | -45.49 | 1 | 3 | 1 | 30 | 260.386 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 6.03 | -6.37 | 0 | 3 | 0 | 29 | 259.378 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.