COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547021
Chemical Name: 4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-(1H-benzimidazol-6-yl)butanamide
Smiles: COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)Nc2ccc3c(c2)[nH]cn3)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 585.66
Empirical Formula: C32H35N5O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.223
Rotatable bonds: 7
H-donors: 4
H-acceptors: 6
PSA: 143
Number of rings: 5

     

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