COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547045
Chemical Name: 6-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-{3-[(1-methyl-1H-imidazol-2-yl)carbonyl]phenyl}hexanamide
Smiles: COc1cc2CC[C@@H](c3c(c2c(c1OC)OC)ccc(c(=O)c3)NCCCCCC(=O)Nc1cccc(c1)C(=O)c1nccn1C)NC(=O)C

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Molecular Weight: 681.79
Empirical Formula: C38H43N5O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.13
Rotatable bonds: 11
H-donors: 3
H-acceptors: 7
PSA: 149
Number of rings: 5

     

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