COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL548768
Chemical Name: 3-(2-{4-[2-(2,5-dimethyl-1H-pyrrol-1-yl)ethyl]piperazin-1-yl}-2-oxoethyl)-5-hydroxy-1,3-dihydro-2H-1,4-benzodiazepin-2-one
Smiles: O=C1Nc2ccccc2C(=NC1CC(=O)N1CCN(CC1)CCn1c(C)ccc1C)O

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Molecular Weight: 423.52
Empirical Formula: C23H29N5O3

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 1.316
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 90
Number of rings: 4

     

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