COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK934971
Chemical Name: 4-butyl-1,5-dioxo-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carboxamide
Smiles: CCCCN1C(=O)c2ccccc2N2C1(CCC2=O)C(=O)/N=c\1/[nH]nc(s1)C(C)C

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Molecular Weight: 427.53
Empirical Formula: C21H25N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.734
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 119
Number of rings: 4

     

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