In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2011 | 25 | Yes |
Popular Name: (2S,6R)-4-(6-ethyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-2-methyl-6-phenyl-morpholine (2S,6R)-4-(6-ethyl-7,8-dihydro-5…
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) | 2.63 | 11.38 | -41.96 | 1 | 5 | 1 | 43 | 339.463 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.63 | 9.09 | -5.68 | 0 | 5 | 0 | 41 | 338.455 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.63 | 11.81 | -103.56 | 2 | 5 | 2 | 44 | 340.471 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.63 | 9.51 | -33.68 | 1 | 5 | 1 | 43 | 339.463 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.