In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 22 | Yes |
Popular Name: 2-[2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]ethyl]-3,4-dihydro-1H-isoquinoline 2-[2-[(1R)-1,2,3,4-tetrahydroiso…
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) | 2.46 | 10 | -41.97 | 2 | 2 | 1 | 16 | 293.434 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 11.26 | -126.07 | 3 | 2 | 2 | 21 | 294.442 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 8.97 | -44.12 | 2 | 2 | 1 | 20 | 293.434 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 7.73 | -4.44 | 1 | 2 | 0 | 15 | 292.426 | 3 | ↓ |