Add molecule
Accepts SMILES, SDF, MOL, MOL2, PDB, PDBQT · auto-normalize · optional 3D embedding
Method 1 — Direct input
✓ NormalizableHeavy atoms: 28 · Rotatable bonds: 8 · QED: 0.65
Method 2 — File upload
Drag & drop or click to select
SDF · MOL · MOL2 · PDB · PDBQT · CSV (SMILES column)
Up to 100,000 molecules · 500 MB per file