| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 15th, 2012 | 30 | Yes |
Popular Name: 1-benzyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)pyrrolo[2,3-b]pyridine-3-carbonitrile 1-benzyl-5-(3,4-dihydro-1H-isoqu…
| 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) | 2.94 | 13.73 | -16.27 | 0 | 5 | 0 | 62 | 392.462 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.