In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 22 | Yes |
Popular Name: 2-(2-ethyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-N-(3-methylisoxazol-5-yl)acetamide 2-(2-ethyl-6,8-dihydro-5H-pyrido…
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) | 0.74 | 5.66 | -62.54 | 2 | 7 | 1 | 85 | 302.358 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.74 | 3.49 | -23.36 | 1 | 7 | 0 | 84 | 301.35 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.