General Information of the Compound
Compound ID
CP0670149
Compound Name
(R)-3-(5-fluoro-1H-indol-3-yl)pyrrolidine-2,5-dione
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Structure
Formula
C12H9FN2O2
Molecular Weight
232.214
Canonical SMILES
O=C1C[C@H](c2c[nH]c3ccc(F)cc23)C(=O)N1
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InChI
InChI=1S/C12H9FN2O2/c13-6-1-2-10-7(3-6)9(5-14-10)8-4-11(16)15-12(8)17/h1-3,5,8,14H,4H2,(H,15,16,17)/t8-/m1/s1
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InChIKey
MXKLDYKORJEOPR-MRVPVSSYSA-N
Physicochemical Property
logP
1.4371
Rotatable Bonds
1
Heavy Atom Count
17
Polar Areas
61.96
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Complexity
17

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 118512017
ChEMBL ID
CHEMBL4061767