COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL238678
Chemical Name: 1-[(5-amino-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]-3-(4-bromophenyl)propan-2-one
Smiles: O=C(Cc1ccc(cc1)Br)CSc1nnc2n1c(N)nc1c2c2CCCCc2s1

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Molecular Weight: 488.43
Empirical Formula: C20H18BrN5OS2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.733
Rotatable bonds: 4
H-donors: 2
H-acceptors: 1
PSA: 139
Number of rings: 5

     

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