|
rdf:type |
|
|
chemicalCompound:parent |
|
|
chemicalCompound:synonym |
|
|
chemicalCompound:standardIn... |
InChI=1S/C18H19F3N2S.ClH/c1-22(2)10-5-11-23-14-6-3-4-7-16(14)24-17-9-8-13(12-15(17)23)18(19,20)21;/h3-4,6-9,12H,5,10-11H2,1-2H3;1H
|
|
chemicalCompound:standardIn... |
FTNWXGFYRHWUKG-UHFFFAOYSA-N
|
|
chemicalCompound:canonicalS... |
Cl.CN(C)CCCN1c2ccccc2Sc3ccc(cc13)C(F)(F)F
|
|
chemicalCompound:molecularF... |
C18H20ClF3N2S
|
|
chemicalCompound:moleculeId |
675053
|
|
chemicalCompound:mwFreebase |
352.417
|
|
chemicalCompound:alogp |
5.017
|
|
chemicalCompound:hba |
3
|
|
chemicalCompound:hbd |
0
|
|
chemicalCompound:psa |
31.78
|
|
chemicalCompound:rtb |
5
|
|
chemicalCompound:ro3Pass |
N
|
|
chemicalCompound:numRo5viol... |
1
|
|
chemicalCompound:medChemFri... |
Y
|
|
chemicalCompound:acdLogP |
5.156
|
|
chemicalCompound:acdLogD |
3.216
|
|
chemicalCompound:molecularS... |
|
|
chemicalCompound:fullMwt |
388.878
|
|
chemicalCompound:acdMostBpk... |
9.404
|
|
chemicalCompound:chemblId |
CHEMBL1201102
|
|
chemicalCompound:maxPhase |
4
|
|
chemicalCompound:therapeuti... |
1
|
|
chemicalCompound:dosedIngre... |
Yes
|
|
chemicalCompound:structureT... |
|
|
chemicalCompound:chebi |
|
|
chemicalCompound:moleculeTy... |
|
|
chemicalCompound:oral |
Yes
|
|
chemicalCompound:parenteral |
Yes
|
|
chemicalCompound:topical |
No
|
|
chemicalCompound:blackBoxWa... |
No
|
|
chemicalCompound:naturalPro... |
No
|
|
chemicalCompound:proDrug |
No
|
|
chemicalCompound:prefName |
TRIFLUPROMAZINE HYDROCHLORIDE
|
|
chemicalCompound:chebiParen... |
|
|
chemicalCompound:activity |
activity:3473278,
activity:3487066,
activity:3487067,
activity:3487068,
activity:3487069,
activity:3487070,
activity:3487071,
activity:3487072,
activity:3635113,
activity:3661994,
activity:3697232,
activity:3828341,
activity:3933190,
activity:3941403,
activity:3974213,
activity:4006835,
activity:4037435,
activity:4053682,
activity:4061675,
activity:4279504,
activity:4331447,
activity:4358757,
activity:4403397,
activity:4404956,
activity:4415302,
activity:4416112,
activity:4419701,
activity:4434998,
activity:4440603,
activity:4536275,
activity:4539077,
activity:4569602,
activity:4690404,
activity:4753906,
activity:4874284,
activity:4904857,
activity:4945818,
activity:4953582,
activity:4970583,
activity:5019130,
activity:5041264,
activity:5065172,
activity:5366445,
activity:5570906,
activity:5590313,
activity:5683458,
activity:5733537,
activity:5790535,
activity:5854015,
activity:5856506,
activity:5866943,
activity:5875814,
activity:5983398,
activity:6491540,
activity:6520155,
activity:6722965,
activity:6836104,
activity:7012583,
activity:7056617,
activity:7107663,
activity:7136580,
activity:7314056,
activity:7369345
|
