COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK678838
Chemical Name: [3-({2-[(3-bromophenyl)amino]-2-oxoethyl}sulfanyl)-5H-[1,2,4]triazino[5,6-b]indol-5-yl]aceticacid
Smiles: O=C(Nc1cccc(c1)Br)CSc1nnc2c(n1)n(CC(=O)O)c1c2cccc1

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Molecular Weight: 472.32
Empirical Formula: C19H14BrN5O3S

Physical State: Dry powder
Available Amount: 63 mg

Lipinsky:
logP: 4.053
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 135
Number of rings: 4

     

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