COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL545353
Chemical Name: N-[(7S)-1,2,3-trimethoxy-10-({4-[4-(2-methoxyphenyl)piperazin-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)N1CCN(CC1)c1ccccc1OC

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Molecular Weight: 644.77
Empirical Formula: C36H44N4O7

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 1.918
Rotatable bonds: 8
H-donors: 2
H-acceptors: 7
PSA: 118
Number of rings: 5

     

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