COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK207393
Chemical Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-({[2-(1H-imidazol-4-yl)ethyl]amino}methylidene)-5-(4-methoxyphenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(cc1)C1=NN(C(=O)/C/1=C\NCCc1c[nH]cn1)c1nc2c(s1)cccc2

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Molecular Weight: 444.52
Empirical Formula: C23H20N6O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.168
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 123
Number of rings: 5

     

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