| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 13 | Yes |
Popular Name: 1-(1-Methylethyl)isoquinoline 1-(1-Methylethyl)isoquinoline
Find On: PubMed — Wikipedia — Google
CAS Numbers: 20922-03-6 , [20922-03-6]
| 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) | 3.33 | 6.85 | -5.26 | 0 | 1 | 0 | 13 | 171.243 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.33 | 7.28 | -25.92 | 1 | 1 | 1 | 14 | 172.251 | 1 | ↓ |
