In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 21 | Yes |
Popular Name: 4-isoquinolylBLAHol 4-isoquinolylBLAHol
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) | 4.08 | 8.01 | -5.69 | 1 | 2 | 0 | 33 | 279.383 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.08 | 8.46 | -34.11 | 2 | 2 | 1 | 34 | 280.391 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.