In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 19 | Yes |
Popular Name: (3R)-3-benzyl-7-ethyl-1,2,3,4-tetrahydroisoquinoline (3R)-3-benzyl-7-ethyl-1,2,3,4-te…
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) | 4.17 | 10.54 | -38.67 | 2 | 1 | 1 | 17 | 252.381 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.17 | 9.39 | -3.17 | 1 | 1 | 0 | 12 | 251.373 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.