COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK578506
Chemical Name: N-(1,3-benzodioxol-5-yl)-2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1COc1ccc(cc1)Cl

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Molecular Weight: 458.93
Empirical Formula: C21H19ClN4O4S

Physical State: Dry powder
Available Amount: 143 mg

Lipinsky:
logP: 5.042
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 4

     

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