COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK991766
Chemical Name: (5Z)-1-[2-(1H-indol-3-yl)ethyl]-4-methyl-2,6-dioxo-5-({[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]amino}methylidene)-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(C)/C(=C/Nc2ccc(cc2)Cn2cncn2)/C(=O)N(C1=O)CCc1c[nH]c2c1cccc2

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Molecular Weight: 477.53
Empirical Formula: C27H23N7O2

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 2.279
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 119
Number of rings: 5

     

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