COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL306089
Chemical Name: methyl2,4-dimethyl-5-({[4-oxo-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)-1H-pyrrole-3-carboxylate
Smiles: C=CCn1c(SCC(=O)c2[nH]c(c(c2C)C(=O)OC)C)nc2c(c1=O)c1CCCc1s2

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Molecular Weight: 457.57
Empirical Formula: C22H23N3O4S2

Available Amount: 0 mg

Lipinsky:
logP: 5.417
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 145
Number of rings: 4

     

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