COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK139889
Chemical Name: 2,4-dichloro-N-{1-[5-({2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-2-methylpropyl}benzamide
Smiles: N#Cc1c(NC(=O)CSc2nnc([nH]2)C(C(C)C)NC(=O)c2ccc(cc2Cl)Cl)sc2c1CCCC2

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Molecular Weight: 563.53
Empirical Formula: C24H24Cl2N6O2S2

Physical State: Dry powder
Available Amount: 78 mg

Lipinsky:
logP: 4.873
Rotatable bonds: 7
H-donors: 3
H-acceptors: 2
PSA: 177
Number of rings: 4

     

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