COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK605328
Chemical Name: 2-(2,5-dichlorophenyl)-5-[(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)carbonyl]-1H-isoindole-1,3(2H)-dione
Smiles: Clc1ccc(c(c1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1)Cl

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Molecular Weight: 537.4
Empirical Formula: C28H22Cl2N2O5

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 4.173
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 76
Number of rings: 6

     

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