| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 4th, 2010 | 8 | Yes |
Popular Name: 1H-Pyrrole-3-carboxamide 1H-Pyrrole-3-carboxamide
Find On: PubMed — Wikipedia — Google
CAS Numbers: 71580-36-4 , [71580-36-4]
1-(3-(piperidin-1-yl)propyl)-3-(piperidin-4-yl)-1H-indole
| 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) | -0.40 | -0.84 | -13.2 | 3 | 3 | 0 | 59 | 110.116 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0599381A1; EP0599381B1; US5316904 | IBM Patent Data |
| PUBCHEM_PATENT_ID | EP0719258A1; US5786367; WO1996002508A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.