COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK581719
Chemical Name: 4-amino-7'-bromo-5'-fluoro-2'-oxo-1',2',6,7,11,12-hexahydro-10H-spiro[1,4-dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-2,3'-indole]-3-carbonitrile
Smiles: N#CC1=C(N)N2CCc3c(C2=CC21C(=O)Nc1c2cc(F)cc1Br)cc1c(c3)OCCCO1

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Molecular Weight: 509.33
Empirical Formula: C24H18BrFN4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.41
Rotatable bonds: 0
H-donors: 3
H-acceptors: 3
PSA: 100
Number of rings: 6

     

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