THE GUARDIAN SHIELD

Smart Guardian System

An intelligent MVP platform dedicated to evaluating chemical compound toxicity indicators

Compound Structure (SMILES):
CC(=O)OC1=CC=CC=C1C(=O)O
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Aspirin

CC(=O)OC1=CC=CC=C1C(=O)O

PubChem Analytics

Aspirin

Lipinski Compliant
1. Physicochemical & ADME Profile
Molecular Weight
180.16 g/mol
Lipophilicity (LogP)
1.19
Polar Surface (TPSA)
63.60 Ų
Rotatable Bonds
3
H-Bond Donors
1
H-Bond Acceptors
4
2. Toxicity & Bioaccumulation Risk
Estimated Risk Level Low Risk
3. Structural Identifiers
Canonical SMILES CC(=O)OC1=CC=CC=C1C(=O)O
InChIKey BSYNRYMUTXBXSQ-UHFFFAOYSA-N

Data source: PubChem PUG REST API (live lookup).