COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567517
Chemical Name: 4-({[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCc1ccc(cc1)C#N

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Molecular Weight: 402.48
Empirical Formula: C22H18N4O2S

Physical State: Dry powder
Available Amount: 81 mg

Lipinsky:
logP: 5.181
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 102
Number of rings: 4

     

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