COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529288
Chemical Name: 8,17-bis(3-tert-butoxy-3-oxopropyl)-11-(2-carbamimidamidoethyl)-1-(9H-fluoren-9-yl)-5-[2-(methylsulfanyl)ethyl]-3,6,9,12,15-pentaoxo-14-(propan-2-yl)-2-oxa-4,7,10,13,16-pentaazaoctadecan-18-oicacid(
Smiles: CSCCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O)CCC(=O)OC(C)(C)C)C(C)C)CCNC(=N)N)CCC(=O)OC(C)(C)C)NC(=O)OCC1c2ccccc2c2c1cccc2

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Molecular Weight: 983.2
Empirical Formula: C48H70N8O12S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 6.62
Rotatable bonds: 29
H-donors: 10
H-acceptors: 12
PSA: 331
Number of rings: 3

     

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