In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2008 | 26 | Yes |
Popular Name: [(1R)-1-(2-pyridyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-(2-thienyl)methanone [(1R)-1-(2-pyridyl)-1,3,4,9-tetr…
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) | 3.71 | 9.14 | -12.99 | 1 | 4 | 0 | 49 | 359.454 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.71 | 10.44 | -41.52 | 2 | 4 | 1 | 50 | 360.462 | 2 | ↓ |