COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK271904
Chemical Name: 1-{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}-2-(9H-xanthen-9-yl)ethanone
Smiles: Cc1cc(n(n1)c1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)CC1c2ccccc2Oc2c1cccc2)C

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Molecular Weight: 523.59
Empirical Formula: C30H29N5O4

Physical State: Dry powder
Available Amount: 212 mg

Lipinsky:
logP: 6.172
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 96
Number of rings: 6

     

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