COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK083036
Chemical Name: 3-(abieta-8,11,13-trien-18-ylamino)-2-(tetrahydrofuran-2-ylmethyl)-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one
Smiles: O=C1N(CC2CCCO2)C(C2=C1CCCC2)NCC1(C)CCCC2(C1CCc1c2ccc(c1)C(C)C)C

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Molecular Weight: 504.76
Empirical Formula: C33H48N2O2

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: 7.097
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 41
Number of rings: 6

     

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