COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL540272
Chemical Name: N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-pyridin-2-yl-L-valinamide
Smiles: COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)Nc2ccccn2)C(C)C)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 560.65
Empirical Formula: C31H36N4O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.571
Rotatable bonds: 5
H-donors: 3
H-acceptors: 6
PSA: 127
Number of rings: 4

     

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