COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL122566
Chemical Name: N-(1-{5-[(2-{[4-(dimethylamino)phenyl]amino}-2-oxoethyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}-2-methylpropyl)-4-methoxybenzamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1C(C(C)C)NC(=O)c1ccc(cc1)OC

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Molecular Weight: 522.67
Empirical Formula: C27H34N6O3S

Available Amount: 0 mg

Lipinsky:
logP: 4.787
Rotatable bonds: 8
H-donors: 2
H-acceptors: 3
PSA: 126
Number of rings: 3

     

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