| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 21 | Yes |
Popular Name: (3S)-N-[(1S,2R,4S)-2,4-dimethylcyclohexyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide (3S)-N-[(1S,2R,4S)-2,4-dimethylc…
| 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) | 2.73 | 6.21 | -7.55 | 2 | 3 | 0 | 41 | 286.419 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.73 | 7.58 | -39.08 | 3 | 3 | 1 | 46 | 287.427 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
