In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 27th, 2011 | 26 | Yes |
Popular Name: 2-amino-4-(cyanomethyl)-6-[2-(2H-indol-3-yl)ethylamino]pyridine-3,5-dicarbonitrile 2-amino-4-(cyanomethyl)-6-[2-(2H…
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) | 1.82 | 6.98 | -42.97 | 4 | 7 | 1 | 136 | 342.386 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.