COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547038
Chemical Name: N-[(7S)-1,2,3-trimethoxy-10-({(2S)-4-methyl-1-[4-(methylsulfonyl)piperazin-1-yl]-1-oxopentan-2-yl}amino)-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Smiles: COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)N2CCN(CC2)S(=O)(=O)C)CC(C)C)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 644.79
Empirical Formula: C32H44N4O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.768
Rotatable bonds: 6
H-donors: 2
H-acceptors: 8
PSA: 151
Number of rings: 4

     

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