COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL549962
Chemical Name: N-[(7S)-1,2,3-trimethoxy-10-({4-[(2S)-2-(1-methyl-1H-benzimidazol-2-yl)pyrrolidin-1-yl]-4-oxobutyl}amino)-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Smiles: COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1[C@H](CC2)NC(=O)C)NCCCC(=O)N1CCC[C@H]1c1nc2c(n1C)cccc2

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Molecular Weight: 653.78
Empirical Formula: C37H43N5O6

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 2.48
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 124
Number of rings: 6

     

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