In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 23 | Yes |
Popular Name: 7-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-ethyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine 7-(2,3-dihydro-1,4-benzodioxin-6…
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) | 1.64 | 8.1 | -49.65 | 1 | 5 | 1 | 49 | 312.393 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 5.83 | -10.31 | 0 | 5 | 0 | 47 | 311.385 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.