COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL548542
Chemical Name: N-[(7S)-10-({6-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-6-oxohexyl}amino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Smiles: COc1ccc(c(c1)OC)C1CCCN1C(=O)CCCCCNc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C

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Molecular Weight: 687.83
Empirical Formula: C39H49N3O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.949
Rotatable bonds: 12
H-donors: 2
H-acceptors: 8
PSA: 124
Number of rings: 5

     

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