COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK840079
Chemical Name: (3aR,4R,7S,7aS)-2-(4-chloro-2-hydroxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Smiles: Clc1ccc(c(c1)O)N1C(=O)[C@@H]2[C@H](C1=O)[C@H]1C[C@@H]2C=C1

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Molecular Weight: 289.72
Empirical Formula: C15H12ClNO3

Physical State: Dry powder
Available Amount: 248 mg

Lipinsky:
logP: 1.916
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 57
Number of rings: 4

     

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