| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 7th, 2011 | 11 | Yes |
Popular Name: 3-(AMINOMETHYL)INDOLE OXALATE 3-(AMINOMETHYL)INDOLE OXALATE
Find On: PubMed — Wikipedia — Google
CAS Number: 296775-93-4
| 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) | 0.66 | 1.83 | -106.26 | 4 | 2 | 2 | 42 | 148.209 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.66 | 1.43 | -26.78 | 3 | 2 | 1 | 40 | 147.201 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.