In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 17 | Yes |
Popular Name: 4-methyl-2-[[(1S)-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]thiazole 4-methyl-2-[[(1S)-1,2,3,4-tetrah…
None
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) | 2.36 | 5.43 | -5.04 | 1 | 2 | 0 | 25 | 244.363 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.36 | 6.73 | -34.19 | 2 | 2 | 1 | 29 | 245.371 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.