COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL227345
Chemical Name: ethyl2-[({[4-oxo-3-(prop-2-en-1-yl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]-4-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccccc1)NC(=O)CSc1nc2sc3c(c2c(=O)n1CC=C)CCCCC3

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Molecular Weight: 579.77
Empirical Formula: C29H29N3O4S3

Available Amount: 0 mg

Lipinsky:
logP: 7.808
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 169
Number of rings: 5

     

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