| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 20 | Yes |
Popular Name: 4-[[(1S)-1-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]methyl]isoxazole 4-[[(1S)-1-methyl-1,3,4,9-tetrah…
| 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) | 2.54 | 7.86 | -48.19 | 2 | 4 | 1 | 46 | 268.34 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 5.76 | -9.77 | 1 | 4 | 0 | 45 | 267.332 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
