COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK585224
Chemical Name: 4-amino-7'-oxo-2',3',6,6',7,7',11,12-octahydro-10H-spiro[1,4-dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-2,8'-[1,4]dioxino[2,3-f]indole]-3-carbonitrile
Smiles: N#CC1=C(N)N2CCc3c(C2=CC21C(=O)Nc1c2cc2OCCOc2c1)cc1c(c3)OCCCO1

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Molecular Weight: 470.48
Empirical Formula: C26H22N4O5

Physical State: Dry powder
Available Amount: 249 mg

Lipinsky:
logP: 3.796
Rotatable bonds: 0
H-donors: 3
H-acceptors: 5
PSA: 119
Number of rings: 7

     

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