COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK274050
Chemical Name: N-{1-[5-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}furan-2-carboxamide
Smiles: C=CCn1c(SCC(=O)N2CCc3c(C2)cccc3)nnc1C(NC(=O)c1ccco1)C

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Molecular Weight: 451.55
Empirical Formula: C23H25N5O3S

Physical State: Dry powder
Available Amount: 129 mg

Lipinsky:
logP: 3.522
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 118
Number of rings: 4

     

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