COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK467602
Chemical Name: methyl5-carbamoyl-2-[({[5-(furan-2-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4-methylthiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CSc2nnc(n2CC2CCCO2)c2ccco2)sc(c1C)C(=O)N

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Molecular Weight: 505.58
Empirical Formula: C21H23N5O6S2

Physical State: Dry powder
Available Amount: 458 mg

Lipinsky:
logP: 2.927
Rotatable bonds: 9
H-donors: 3
H-acceptors: 6
PSA: 205
Number of rings: 4

     

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