COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK540098
Chemical Name: (2E)-N-[(4-benzylpiperazin-1-yl)carbonothioyl]-3-(4-methoxyphenyl)prop-2-enamide
Smiles: COc1ccc(cc1)/C=C/C(=O)NC(=S)N1CCN(CC1)Cc1ccccc1

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Molecular Weight: 395.53
Empirical Formula: C22H25N3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.145
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 76
Number of rings: 3

     

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