| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 21 | Yes |
Popular Name: 6-(5-amino-3,4-dihydro-1H-isoquinoline-2-carbonyl)-1H-pyrimidine-2,4-dione 6-(5-amino-3,4-dihydro-1H-isoqui…
| 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) | 0.28 | 0.22 | -36.13 | 3 | 7 | -1 | 115 | 285.283 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.18 | 0.8 | -10.84 | 4 | 7 | 0 | 112 | 286.291 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
