| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2010 | 25 | Yes |
Popular Name: tert-butyl (1r,4r)-4-(5,6,7,8-tetrahydroquinolin-8-ylamino)cyclohexylcarbamate tert-butyl (1r,4r)-4-(5,6,7,8-te…
Find On: PubMed — Wikipedia — Google
CAS Number: 558442-80-1
| 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) | 5.21 | 6.59 | -6.8 | 2 | 5 | 0 | 63 | 345.487 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.21 | 7.84 | -37.98 | 3 | 5 | 1 | 68 | 346.495 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 5.21 | 6.78 | -34.24 | 3 | 5 | 1 | 64 | 346.495 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 5.21 | 7.59 | -111.18 | 4 | 5 | 2 | 69 | 347.503 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.