| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 4th, 2011 | 23 | Yes |
Popular Name: N-[3-[ethyl(methyl)amino]phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide N-[3-[ethyl(methyl)amino]phenyl]…
| 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) | 3.54 | 9.83 | -9.7 | 1 | 4 | 0 | 36 | 309.413 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.54 | 10.25 | -27.9 | 2 | 4 | 0 | 37 | 310.421 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
