COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL542385
Chemical Name: methyl4-({N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]glycyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CNc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C

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Molecular Weight: 575.62
Empirical Formula: C31H33N3O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.677
Rotatable bonds: 6
H-donors: 3
H-acceptors: 8
PSA: 141
Number of rings: 4

     

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