COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK591691
Chemical Name: (4E)-2-(2,4-dimethoxyphenyl)-4-({[(1-ethylpyrrolidin-2-yl)methyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccc(c(c1)OC)N1C(=O)/C(=C/NCC2CCCN2CC)/c2c(C1=O)cccc2

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Molecular Weight: 435.52
Empirical Formula: C25H29N3O4

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 3.17
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 4

     

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