COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL542525
Chemical Name: 4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-{[1-(propan-2-yl)-1H-benzimidazol-2-yl]methyl}butanamide
Smiles: COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1[C@H](CC2)NC(=O)C)NCCCC(=O)NCc1nc2c(n1C(C)C)cccc2

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Molecular Weight: 641.77
Empirical Formula: C36H43N5O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.714
Rotatable bonds: 10
H-donors: 3
H-acceptors: 6
PSA: 132
Number of rings: 5

     

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