COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK139421
Chemical Name: 4-(5-oxo-6,12-dihydro-5H-benzo[b]indeno[1,2-e][1,4]thiazepin-6-yl)phenyl4-chlorobenzoate
Smiles: Clc1ccc(cc1)C(=O)Oc1ccc(cc1)C1Sc2ccccc2NC2=C1C(=O)c1c2cccc1

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Molecular Weight: 495.99
Empirical Formula: C29H18ClNO3S

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 7.572
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 80
Number of rings: 6

     

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