COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL537469
Chemical Name: (3E,8xi)-3-[(4-methylpiperazin-1-yl)imino]carda-14,16,20(22)-trienolide
Smiles: CN1CCN(CC1)/N=C/1\CC[C@]2(C(C1)CCC1[C@@H]2CC[C@]2(C1=CC=C2C1=CC(=O)OC1)C)C

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Molecular Weight: 449.64
Empirical Formula: C28H39N3O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.09
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 45
Number of rings: 6

     

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