Compound Profiler
Assess drug-likeness with Lipinski Ro5, QED score, PAINS structural alerts, and a 6-axis bioavailability radar. Supports single and batch analysis up to 100 compounds.
Example:
CC(=O)Oc1ccccc1C(=O)O (Aspirin)
WARN Borderline
Calculated Properties
MW (g/mol)
436.56
LogP
4.95
TPSA (Ų)
39.15
H-Donors
0
H-Acceptors
4
QED
0.543
Rotatable
4
Fraction Csp3
0.214
Arom. Rings
3
RO5 Violations
0
ESOL Log S
-7.62
Structural Alerts
1 alert(s) found:
- ene_five_het_A(201)
Batch Analysis (up to 100 compounds)
Click to expand
Calculate properties and assess drug-likeness for multiple SMILES at once.