COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK621606
Chemical Name: (4E)-2-(3-chlorophenyl)-4-({[2-(dimethylamino)-2-(furan-2-yl)ethyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: CN(C(c1ccco1)CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1cccc(c1)Cl)C

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Molecular Weight: 435.91
Empirical Formula: C24H22ClN3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.4
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 65
Number of rings: 4

     

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