COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL546012
Chemical Name: N~2~-[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[2-(hydroxymethyl)-1H-benzimidazol-6-yl]valinamide
Smiles: COc1c2c(CCC(c3c2ccc(c(=O)c3)NC(C(=O)Nc2ccc3c(c2)[nH]c(n3)CO)C(C)C)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 629.71
Empirical Formula: C34H39N5O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.646
Rotatable bonds: 9
H-donors: 5
H-acceptors: 7
PSA: 163
Number of rings: 5

     

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