COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK641452
Chemical Name: methyl(2E)-2-{[4-(8-fluoro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-4-oxobutanoyl]imino}-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: COC(=O)c1s/c(=N/C(=O)CCC(=O)N2CCc3c(C2)c2cc(F)ccc2[nH]3)/[nH]c1C

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Molecular Weight: 444.49
Empirical Formula: C21H21FN4O4S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 2.399
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 129
Number of rings: 4

     

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