COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK624405
Chemical Name: (4E)-2-(3-chlorophenyl)-4-({[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccc2c(c1)c(CCN/C=C/1\c3ccccc3C(=O)N(C1=O)c1cccc(c1)Cl)c[nH]2

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Molecular Weight: 471.94
Empirical Formula: C27H22ClN3O3

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 5.115
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 74
Number of rings: 5

     

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