COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL277001
Chemical Name: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc3c(c2)OCCCO3)nnc1COc1ccc(cc1)Cl

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Molecular Weight: 486.98
Empirical Formula: C23H23ClN4O4S

Available Amount: 0 mg

Lipinsky:
logP: 5.244
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 4

     

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