| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2005 | 16 | Yes |
Popular Name: 3-Phenylisoquinoline 3-Phenylisoquinoline
Find On: PubMed — Wikipedia — Google
CAS Number: 37993-76-3
| 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) | 3.94 | 1.08 | -7.15 | 0 | 1 | 0 | 12 | 205.26 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 3.94 | 1.21 | -29.91 | 1 | 1 | 1 | 14 | 206.268 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 101 - 104 | MolMall (formerly Molecular Diversity Preservation International) |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
