In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 22 | Yes |
Popular Name: 4-[(2-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)methyl]-2-(3-thienyl)thiazole 4-[(2-methyl-6,8-dihydro-5H-pyri…
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) | 2.24 | 8.44 | -45.67 | 1 | 4 | 1 | 43 | 329.474 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 6.15 | -10.52 | 0 | 4 | 0 | 42 | 328.466 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.