In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2011 | 20 | Yes |
Popular Name: 4-[[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]amino]benzonitrile 4-[[2-oxo-2-(1,2,5-trimethylpyrr…
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) | 2.05 | 8.16 | -10.3 | 1 | 4 | 0 | 58 | 267.332 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.