COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK544952
Chemical Name: ethyl4-[({[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

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Molecular Weight: 563.7
Empirical Formula: C28H29N5O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.047
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 160
Number of rings: 6

     

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