Aplindore
(2S)-2-[(benzylamino)methyl]-2,3,7,9-tetrahydro-[1,4]dioxino[2,3-e]indol-8-one
Molecular Identity
Aplindore
(2S)-2-[(benzylamino)methyl]-2,3,7,9-tetrahydro-[1,4]dioxino[2,3-e]indol-8-one
PubChem CID: 158784
Aplindore is an organic molecular entity.
2D Structure
Properties
C18H18N2O3
Molecular Formula
310.30
Molecular Weight
g/mol
310.1317
Exact Mass
Da
1.6
XLogP
Drug-like (Lipinski: < 5)
59.6
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
4
H-Bond Acceptors
424
Complexity
SMILES
Canonical SMILES
SMILES: C1C(OC2=C(O1)C=CC3=C2CC(=O)N3)CNCC4=CC=CC=C4Isomeric SMILES
SMILES: C1[C@@H](OC2=C(O1)C=CC3=C2CC(=O)N3)CNCC4=CC=CC=C4Synonyms(20)
AplindorePalindore189681-70-7Aplindore [INN]Palindore [INN]aplindorUNII-Q5O76TA0MLQ5O76TA0ML(2S)-2-((BENZYLAMINO)METHYL)-2,3,7,9-TETRAHYDRO-8H-(1,4)DIOXINO(2,3-E)INDOL-8-ONE(2S)-2-((Benzylamino)methyl)-2,3,7,9-tetrahydro-8H-1,4-dioxino(2,3-e)indol-8-one(2S)-2-[(benzylamino)methyl]-2H,3H,7H,8H,9H-[1,4]dioxino[2,3-e]indol-8-one8H-1,4-DIOXINO(2,3-E)INDOL-8-ONE, 2,3,7,9-TETRAHYDRO-2-(((PHENYLMETHYL)AMINO)METHYL)-, (2S)-aplindorum(2S)-2-((benzylamino)methyl)-2H,3H,7H,8H,9H-(1,4)dioxino(2,3-e)indol-8-one(2S)-2-[(benzylamino)methyl]-2,3,7,9-tetrahydro-8H-[1,4]dioxino[2,3-e]indol-8-one
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Aplindore
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