COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK734701
Chemical Name: 1'-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-3a,4,5,6,7,7a-hexahydrospiro[1,3-benzodioxole-2,3'-indol]-2'(1'H)-one
Smiles: Clc1cccc(c1)N1CCN(CC1)CN1c2ccccc2C2(C1=O)OC1C(O2)CCCC1

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Molecular Weight: 453.97
Empirical Formula: C25H28ClN3O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.368
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 45
Number of rings: 6

     

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