COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK702265
Chemical Name: 11-[(5Z)-5-(1-{2-[(4-fluorophenyl)amino]-2-oxoethyl}-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]undecanoicacid
Smiles: O=C(CN1C(=O)/C(=C/2\SC(=S)N(C2=O)CCCCCCCCCCC(=O)O)/c2c1cccc2)Nc1ccc(cc1)F

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Saltdata: 1/3 CH3COOH
Molecular Weight: 597.73
Empirical Formula: C30H32FN3O5S2

Physical State: Dry powder
Available Amount: 401 mg

Lipinsky:
logP: 4.59
Rotatable bonds: 14
H-donors: 2
H-acceptors: 5
PSA: 164
Number of rings: 4

     

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