COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK032869
Chemical Name: (4E)-2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-4-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(cc1)C1=NN(C(=O)/C/1=C/NCC1CCCO1)c1nc2c(s1)cccc2

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Molecular Weight: 434.52
Empirical Formula: C23H22N4O3S

Physical State: Dry powder
Available Amount: 62 mg

Lipinsky:
logP: 3.361
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 104
Number of rings: 5

     

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