| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 12 | Yes |
Popular Name: Isoquinoline, 5-ethyl- (9CI) Isoquinoline, 5-ethyl- (9CI)
Find On: PubMed — Wikipedia — Google
CAS Number: 54415-46-2
| 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) | 2.92 | 6.29 | -4.94 | 0 | 1 | 0 | 13 | 157.216 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.92 | 6.75 | -31.6 | 1 | 1 | 1 | 14 | 158.224 | 1 | ↓ |
