COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565983
Chemical Name: N-[N-(6-{[(4-chlorophenyl)sulfanyl]methyl}-4-oxo-1,4-dihydropyrimidin-2-yl)-N'-(3-methylphenyl)carbamimidoyl]-2-phenylbutanamide
Smiles: CCC(c1ccccc1)C(=O)N/C(=N\c1cccc(c1)C)/Nc1nc(=O)cc([nH]1)CSc1ccc(cc1)Cl

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Molecular Weight: 546.09
Empirical Formula: C29H28ClN5O2S

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 7.261
Rotatable bonds: 4
H-donors: 3
H-acceptors: 2
PSA: 120
Number of rings: 4

     

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