COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK152824
Chemical Name: (2E)-3-{1-[4-(dimethylamino)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoicacid
Smiles: OC(=O)/C(=C\c1cc(n(c1C)c1ccc(cc1)N(C)C)C)/Sc1nnc([nH]1)C

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Molecular Weight: 397.5
Empirical Formula: C20H23N5O2S

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 4.92
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 112
Number of rings: 3

     

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