| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 4th, 2011 | 23 | No |
Popular Name: (2S)-3-[(E)-(4-methoxyphenyl)methyliminomethyl]-2H-indole-2-carboxylic (2S)-3-[(E)-(4-methoxyphenyl)met…
| 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) | 0.96 | 7.95 | -66.05 | 2 | 5 | 1 | 77 | 309.345 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.96 | 7.15 | -28.37 | 1 | 5 | 0 | 76 | 308.337 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
