COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL543658
Chemical Name: N~2~-[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[3-(4H-1,2,4-triazol-3-yl)phenyl]valinamide
Smiles: COc1c2c(CCC(c3c2ccc(c(=O)c3)NC(C(=O)Nc2cccc(c2)c2nnc[nH]2)C(C)C)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 626.71
Empirical Formula: C34H38N6O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.786
Rotatable bonds: 8
H-donors: 4
H-acceptors: 6
PSA: 156
Number of rings: 5

     

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