| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 27th, 2010 | 25 | Yes |
Popular Name: [5-[[(1R,9aS)-1-isobutyl-1,3,4,9a-tetrahydropyrido[3,4-b]indol-2-yl]methyl]-2-furyl]methanol [5-[[(1R,9aS)-1-isobutyl-1,3,4,9…
| 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) | 4.24 | 8.53 | -40.6 | 3 | 4 | 1 | 54 | 339.459 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.24 | 7.2 | -9.02 | 2 | 4 | 0 | 52 | 338.451 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
