COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL548475
Chemical Name: 4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[3-(methylsulfanyl)phenyl]butanamide
Smiles: CSc1cccc(c1)NC(=O)CCCNc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C

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Molecular Weight: 591.73
Empirical Formula: C32H37N3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.112
Rotatable bonds: 8
H-donors: 3
H-acceptors: 6
PSA: 140
Number of rings: 4

     

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