COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL544935
Chemical Name: 4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[3-(2-methoxyphenyl)-1H-1,2,4-triazol-5-yl]butanamide
Smiles: COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1[C@H](CC2)NC(=O)C)NCCCC(=O)Nc1[nH]nc(n1)c1ccccc1OC

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Molecular Weight: 642.71
Empirical Formula: C34H38N6O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.853
Rotatable bonds: 9
H-donors: 4
H-acceptors: 7
PSA: 165
Number of rings: 5

     

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