COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037351
Chemical Name: 8-chloro-2-hydroxy-3-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1cc(/C=N/n2c(O)nc3c(c2=O)[nH]c2c3cc(cc2)Cl)cc(c1OC)OC

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Molecular Weight: 428.83
Empirical Formula: C20H17ClN4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.136
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 108
Number of rings: 4

     

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