| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 20 | Yes |
Popular Name: [(2S,3aR,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indol-2-yl]-indolin-1-yl-methanone [(2S,3aR,7aS)-2,3,3a,4,5,6,7,7a-…
| 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) | 3.93 | 8.11 | -42.46 | 2 | 3 | 1 | 37 | 271.384 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.93 | 6.88 | -12.81 | 1 | 3 | 0 | 32 | 270.376 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
