COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK108952
Chemical Name: methyl4-{(E)-[2-({[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoate
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)N/N=C/c1ccc(cc1)C(=O)OC

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Molecular Weight: 536.01
Empirical Formula: C26H22ClN5O4S

Physical State: Dry powder
Available Amount: 410 mg

Lipinsky:
logP: 8.125
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 133
Number of rings: 4

     

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