COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL333469
Chemical Name: 3-{[(1E,2E)-2-benzylideneheptylidene]amino}-2-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCCCC/C(=C\c1ccccc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

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Molecular Weight: 398.51
Empirical Formula: C25H26N4O

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.148
Rotatable bonds: 6
H-donors: 1
H-acceptors: 1
PSA: 60
Number of rings: 4

     

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