COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK119028
Chemical Name: (5E)-5-(1H-indol-3-ylmethylidene)-1-[4-(propan-2-yl)phenyl]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1NC(=O)/C(=C\c2c[nH]c3c2cccc3)/C(=O)N1c1ccc(cc1)C(C)C

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Molecular Weight: 389.48
Empirical Formula: C22H19N3O2S

Physical State: Dry powder
Available Amount: 268 mg

Lipinsky:
logP: 4.519
Rotatable bonds: 1
H-donors: 2
H-acceptors: 2
PSA: 97
Number of rings: 4

     

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