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Other ion channels

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  1. Toremifene
    Cas Number: 89778-26-7        Compound CID:  3005573
    Formula:  C26H28ClNO        Molecular Weight: 405.96
    IUPAC Name:  2-[4-[(Z)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine
    SMILES:  CN(C)CCOC1=CC=C(C=C1)C(=C(CCCl)C2=CC=CC=C2)C3=CC=CC=C3
    InChIKey: XFCLJVABOIYOMF-QPLCGJKRSA-N
    InChI:  InChI=1S/C26H28ClNO/c1-28(2)19-20-29-24-15-13-23(14-16-24)26(22-11-7-4-8-12-22)25(17-18-27)21-9-5-3-6-10-21/h3-16H,17-20H2,1-2H3/b26-25-
    Synonyms: Z-Toremifene | NK 622 free base | FC-1157a free base
  2. 3-phenyl-CPP, Channel blocker of ClC-Ka;Channel blocker of ClC-Kb
    IUPAC Name:  2-(4-chlorophenoxy)-3-phenylpropanoic acid
    SMILES:  OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)Cl
    InChIKey: CPBLTMSKPQDJPW-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H13ClO3/c16-12-6-8-13(9-7-12)19-14(15(17)18)10-11-4-2-1-3-5-11/h1-9,14H,10H2,(H,17,18)
    Synonyms: GTPL4104 | EN300-43356163 | 2-(4-chlorophenoxy)-3-phenylpropanoic acid | SCHEMBL20553475 | Q27073745 | 3-phenyl-CPP |...
  3. ABBV-3221, Activator of CFTR
    IUPAC Name:  (2S,3R,4S,5S)-3-tert-Butyl-4-{[2-methoxy-5-(trifluoromethyl)pyridin-3-yl]methoxy}-5-(2-methylphenyl)-1-[(2S)-oxane-2-carbonyl]pyrrolidine-2-carboxylicshow more
    SMILES:  COc1ncc(cc1CO[C@@H]1[C@@H](N([C@@H]([C@H]1C(C)(C)C)C(=O)O)C(=O)[C@@H]1CCCCO1)c1ccccc1C)C(F)(F)F
    InChIKey: YFEYDNAKCSOOOG-YCXOGWGTSA-N
    InChI:  InChI=1S/C30H37F3N2O6/c1-17-10-6-7-11-20(17)23-25(41-16-18-14-19(30(31,32)33)15-34-26(18)39-5)22(29(2,3)4)24(28(37)38)35(23)27(36)21-12-8-9-13-40-21/hshow more
    Synonyms: ABBV/GLPG-3221;compound 19
  4. CRAC channel inhibitor 5b, Channel blocker of Orai1
    IUPAC Name:  1-(4-chlorophenyl)-1,3-dimethyl-3-[1-(4-methylphenyl)propyl]urea
    SMILES:  CCC(N(C(=O)N(c1ccc(cc1)Cl)C)C)c1ccc(cc1)C
    InChIKey: YPDVKFTYHRFBSZ-UHFFFAOYSA-N
    InChI:  InChI=1S/C19H23ClN2O/c1-5-18(15-8-6-14(2)7-9-15)22(4)19(23)21(3)17-12-10-16(20)11-13-17/h6-13,18H,5H2,1-4H3
  5. CRAC channel inhibitor 1, Channel blocker of Orai1
    IUPAC Name:  3-(4-chlorophenyl)-1-[1-(4-methylphenyl)propyl]urea
    SMILES:  CCC(c1ccc(cc1)C)NC(=O)Nc1ccc(cc1)Cl
    InChIKey: FKBYZUDELOWDJW-UHFFFAOYSA-N
    InChI:  InChI=1S/C17H19ClN2O/c1-3-16(13-6-4-12(2)5-7-13)20-17(21)19-15-10-8-14(18)9-11-15/h4-11,16H,3H2,1-2H3,(H2,19,20,21)
  6. CM4620, Channel blocker of Orai1;Channel blocker of Orai2
    IUPAC Name:  N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluoro-6-methylbenzamide
    SMILES:  Clc1cc2OC(Oc2cc1c1ncc(nc1)NC(=O)c1c(C)cccc1F)(F)F
    InChIKey: QQMKTHUGOQDEIL-UHFFFAOYSA-N
    InChI:  InChI=1S/C19H11ClF3N3O3/c1-9-3-2-4-12(21)17(9)18(27)26-16-8-24-13(7-25-16)10-5-14-15(6-11(10)20)29-19(22,23)28-14/h2-8H,1H3,(H,25,26,27)
    Synonyms: BS-15636 | CM 4620 | C73294 | BDBM50575336 | SCHEMBL18038390 | CS-0022201 | 564AW1RR37 | SB18686 | AC-35758 | CM4620 ...
  7. GTPγS
    IUPAC Name:  ({[({[5-(2-amino-6-oxo-6,9-dihydro-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)(sulfanylidene)phosshow more
    SMILES:  OC1C(COP(=O)(OP(=O)(OP(=S)(O)O)O)O)OC(C1O)n1cnc2c1[nH]c(N)nc2=O
    InChIKey: XOFLBQFBSOEHOG-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H16N5O13P3S/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(26-9)1-25-29(19,20)27-30(21,22)28-31(23,24)32/h2-3,5-6,9,16-17H,1H2,(H,19,20)show more
    Synonyms: GTPgammaS|GTP[S]|GTPL4207|BDBM81823|DTXSID50274330|CAS_444121|NSC_444121|Q27077929|({[({[5-(2-amino-6-oxo-6,9-dihydro...
  8. Ins(3,4,5,6)P₄, Channel blocker of CaCC
    Cas Number: 112791-61-4        Compound CID:  121920
    IUPAC Name:  [(1R,2S,3S,4R,5S,6R)-3,4-dihydroxy-2,5,6-triphosphonooxycyclohexyl] dihydrogen phosphate
    SMILES:  O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]([C@H]([C@@H]1O)OP(=O)(O)O)OP(=O)(O)O
    InChIKey: MRVYFOANPDTYBY-UZAAGFTCSA-N
    InChI:  InChI=1S/C6H16O18P4/c7-1-2(8)4(22-26(12,13)14)6(24-28(18,19)20)5(23-27(15,16)17)3(1)21-25(9,10)11/h1-8H,(H2,9,10,11)(H2,12,13,14)(H2,15,16,17)(H2,18,1show more
    Synonyms: DTXSID80920893 | (1S,2R,3R,4S,5R,6S)-5,6-dihydroxycyclohexane-1,2,3,4-tetrayl tetrakis[dihydrogen (phosphate)] | inos...
  9. SITS, Channel blocker of CaCC
    Cas Number: 27816-59-7        Compound CID:  5311433
    IUPAC Name:  5-acetamido-2-[(E)-2-(5-isothiocyanato-2-sulfophenyl)ethenyl]benzenesulfonic acid
    SMILES:  S=C=Nc1ccc(c(c1)/C=C/c1ccc(cc1S(=O)(=O)O)NC(=O)C)S(=O)(=O)O
    InChIKey: JPFIABFQSOJRGG-NSCUHMNNSA-N
    InChI:  InChI=1S/C17H14N2O7S3/c1-11(20)19-15-5-4-12(17(9-15)29(24,25)26)2-3-13-8-14(18-10-27)6-7-16(13)28(21,22)23/h2-9H,1H3,(H,19,20)(H,21,22,23)(H,24,25,26)show more
    Synonyms: 4'-isothiocyanostilbene-2,2'-disulphonic acid
  10. UCCF-339, Activator of CFTR
    Cas Number: 652138-15-3        Compound CID:  71376521
    IUPAC Name:  6-(furan-2-yl)-2-(pyridin-4-yl)-4H-benzo[h]chromen-4-one
    SMILES:  O=c1cc(oc2c1cc(c1ccco1)c1c2cccc1)c1ccncc1
    InChIKey: YYRINQRAIIGEQV-UHFFFAOYSA-N
    InChI:  InChI=1S/C22H13NO3/c24-19-13-21(14-7-9-23-10-8-14)26-22-16-5-2-1-4-15(16)17(12-18(19)22)20-6-3-11-25-20/h1-13H
    Synonyms: UCCF-339|652138-15-3|6-(Furan-2-yl)-2-(pyridin-4-yl)-4H-naphtho[1,2-b]pyran-4-one|GTPL4337|DTXSID60799206|4H-Naphtho[...
  11. [(2S)-4-[7-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-2-methylpiperazin-1-yl]-phenylmethanone, Activator of CFTR
    IUPAC Name:  [(2S)-4-[7-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-2-methylpiperazin-1-yl]-phenylmethanone
    SMILES:  C[C@H]1CN(CCN1C(=O)c1ccccc1)C(=O)c1nn2c(c3ccc(c(c3)OC)OC)ccnc2c1
    InChIKey: IZQQHYQEKBFWAG-SFHVURJKSA-N
    InChI:  InChI=1S/C27H27N5O4/c1-18-17-30(13-14-31(18)26(33)19-7-5-4-6-8-19)27(34)21-16-25-28-12-11-22(32(25)29-21)20-9-10-23(35-2)24(15-20)36-3/h4-12,15-16,18Hshow more
    Synonyms: compound 16d
  12. diBA-(5)-C4
    IUPAC Name:  1,3-dibutyl-5-[5-(1,3-dibutyl-6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)penta-2,4-dien-1-ylidene]-1,3-diazinane-2,4,6-trione
    SMILES:  CCCCN1C(=O)C(=CC=CC=Cc2c(O)n(CCCC)c(=O)n(c2=O)CCCC)C(=O)N(C1=O)CCCC
    InChIKey: CQAPPGVBCMJDML-UHFFFAOYSA-N
    InChI:  InChI=1S/C29H42N4O6/c1-5-9-18-30-24(34)22(25(35)31(28(30)38)19-10-6-2)16-14-13-15-17-23-26(36)32(20-11-7-3)29(39)33(27(23)37)21-12-8-4/h13-17,34H,5-12show more
    Synonyms: bis-(1,3-dibutylbarbituric acid)pentamethine oxanol | oxalon dye
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