COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK102012
Chemical Name: 2-[(4-methyl-3-phenyl-3H-1,5-benzodiazepin-2-yl)amino]-2-oxoethyl4-methylpiperazine-1-carbodithioate
Smiles: CN1CCN(CC1)C(=S)SCC(=O)NC1=Nc2ccccc2N=C(C1c1ccccc1)C

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Molecular Weight: 465.64
Empirical Formula: C24H27N5OS2

Physical State: Dry powder
Available Amount: 459 mg

Lipinsky:
logP: 1.246
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 117
Number of rings: 4

     

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