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Quick search ChEMBL 36

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)
Free Research Context Use this tool freely, then open the research home or demo workspace when you want project context.
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OK Drug-like

Calculated Properties

MW (g/mol)
359.39
LogP
3.48
TPSA (Ų)
86.02
H-Donors
2
H-Acceptors
5
QED
0.75
Rotatable
3
Fraction Csp3
0.095
Arom. Rings
3
RO5 Violations
0
ESOL Log S
-6.29

Structural Alerts 🔴

2 alert(s) found:
  • hzone_phenol_A(479)
  • mannich_A(296)
Batch Analysis (up to 100 compounds)
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Calculate properties and assess drug-likeness for multiple SMILES at once.

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