d3s-001 (CHEBI:759605)

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CHEBI:759605 - d3s-001

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ChEBI ID	CHEBI:759605
ChEBI Name	d3s-001
Stars
Last Modified	30 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C32H35F6N7O3
Net Charge	0
Average Mass	679.666
Monoisotopic Mass	679.27056
SMILES	C=C(F)C(=O)N1CCN(c2nc(OC[C@@]34CCCN3C[C@H](F)C4)nc3c2CO[C@H](c2c(F)c(N)cc(C)c2C(F)(F)F)C3)C[C@@H]1CC#N
InChI	InChI=1S/C32H35F6N7O3/c1-17-10-22(40)27(35)25(26(17)32(36,37)38)24-11-23-21(15-47-24)28(43-8-9-45(29(46)18(2)33)20(14-43)4-6-39)42-30(41-23)48-16-31-5-3-7-44(31)13-19(34)12-31/h10,19-20,24H,2-5,7-9,11-16,40H2,1H3/t19-,20+,24+,31+/m1/s1
InChIKey	JOLORSRKBHXPFT-PNGHJTAWSA-N

Roles Classification

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	d3s-001 (CHEBI:759605) is a N-arylpiperazine (CHEBI:46848)

Synonym	Source
D3s-001	ChEMBL