COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL542111
Chemical Name: N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-benzyl-L-leucinamide
Smiles: COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)NCc2ccccc2)CC(C)C)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 587.72
Empirical Formula: C34H41N3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.482
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 114
Number of rings: 4

     

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