COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK665784
Chemical Name: methyl2-{[2-({2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}amino)-2-oxoethyl]sulfanyl}benzoate
Smiles: COc1cc(Cc2nccc3c2cc(OC)c(c3)OC)c(cc1OC)NC(=O)CSc1ccccc1C(=O)OC

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Molecular Weight: 562.64
Empirical Formula: C30H30N2O7S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.32
Rotatable bonds: 11
H-donors: 1
H-acceptors: 7
PSA: 130
Number of rings: 4

     

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