COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK714501
Chemical Name: methyl4-{(E)-[(2-amino-3-{[2-(4-methoxyphenyl)ethyl]carbamoyl}-1H-pyrrolo[2,3-b]quinoxalin-1-yl)imino]methyl}benzoate
Smiles: COc1ccc(cc1)CCNC(=O)c1c2nc3ccccc3nc2n(c1N)/N=C/c1ccc(cc1)C(=O)OC

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Molecular Weight: 522.56
Empirical Formula: C29H26N6O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.166
Rotatable bonds: 5
H-donors: 3
H-acceptors: 4
PSA: 133
Number of rings: 5

     

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