COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK041967
Chemical Name: (6Z)-5-imino-6-({1-[2-(3-methoxyphenoxy)ethyl]-1H-pyrrol-2-yl}methylidene)-2-(propan-2-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cccc(c1)OCCn1cccc1/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C(C)C

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Molecular Weight: 437.52
Empirical Formula: C22H23N5O3S

Physical State: Dry powder
Available Amount: 87 mg

Lipinsky:
logP: 2.33
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 117
Number of rings: 4

     

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