COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL371700
Chemical Name: (2E)-2-cyano-3-[4-(1,3-dihydro-2H-isoindol-2-yl)phenyl]-N-(thiophen-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)N1Cc2c(C1)cccc2)/C(=O)NCc1cccs1

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Molecular Weight: 385.49
Empirical Formula: C23H19N3OS

Physical State: Dry powder
Available Amount: 202 mg

Lipinsky:
logP: 4.163
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 84
Number of rings: 4

     

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