Chemie Search results for query - 日本蛋白質結構資料庫

English 日本語简体中文繁體中文 한국어

✖

Menu

RCSB PDB PDBe BMRB Adv. Search Search help

PDB Info pages Status search Chemie search: 2024 results BIRD

DBX

DBX
Name:	2,5-dihydroxybenzenesulfonic acid
Formula:	C6 H6 O5 S
SMILES:	O=S(=O)(O)c1cc(O)ccc1O
InChi:	InChI=1S/C6H6O5S/c7-4-1-2-5(8)6(3-4)12(9,10)11/h1-3,7-8H,(H,9,10,11)
Definition date:	2009-10-01
Last modified:	2011-06-04
Identifier:	2,5-dihydroxybenzenesulfonic acid

DC5

DC5
Name:	2,6-DICHLOROBIPHENYL
Formula:	C12 H8 Cl2
SMILES:	Clc2cccc(Cl)c2c1ccccc1
InChi:	InChI=1S/C12H8Cl2/c13-10-7-4-8-11(14)12(10)9-5-2-1-3-6-9/h1-8H
Definition date:	2010-09-29
Last modified:	2011-06-04
Identifier:	2,6-dichlorobiphenyl

DFT

DFT
Name:	1-[2-DEOXYRIBOFURANOSYL]-2,4-DIFLUORO-5-METHYL-BENZENE-5'MONOPHOSPHATE
Formula:	C12 H15 F2 O6 P
SMILES:	O=P(OCC2OC(c1cc(c(F)cc1F)C)CC2O)(O)O
InChi:	InChI=1S/C12H15F2O6P/c1-6-2-7(9(14)3-8(6)13)11-4-10(15)12(20-11)5-19-21(16,17)18/h2-3,10-12,15H,4-5H2,1H3,(H2,16,17,18)/t10-,11+,12+/m0/s1
Definition date:	1999-09-28
Last modified:	2011-06-04
Identifier:	(1R)-1,4-anhydro-2-deoxy-1-(2,4-difluoro-5-methylphenyl)-5-O-phosphono-D-erythro-pentitol

AYX

AYX
Name:	4-{[(3-nitrophenyl)carbamoyl]amino}benzenesulfonamide
Formula:	C13 H12 N4 O5 S
SMILES:	O=S(=O)(N)c2ccc(NC(=O)Nc1cccc([N+]([O-])=O)c1)cc2
InChi:	InChI=1S/C13H12N4O5S/c14-23(21,22)12-6-4-9(5-7-12)15-13(18)16-10-2-1-3-11(8-10)17(19)20/h1-8H,(H2,14,21,22)(H2,15,16,18)
Definition date:	2010-05-26
Last modified:	2011-06-04
Identifier:	4-{[(3-nitrophenyl)carbamoyl]amino}benzenesulfonamide

F3B

F3B
Name:	1,3,5-trichloro-2,4,6-trifluorobenzene
Formula:	C6 Cl3 F3
SMILES:	Clc1c(F)c(Cl)c(F)c(Cl)c1F
InChi:	InChI=1S/C6Cl3F3/c7-1-4(10)2(8)6(12)3(9)5(1)11
Definition date:	2008-07-16
Last modified:	2011-06-04
Identifier:	1,3,5-trichloro-2,4,6-trifluorobenzene

F5B

F5B
Name:	1,2,3,4,5-pentafluorobenzene
Formula:	C6 H F5
SMILES:	Fc1cc(F)c(F)c(F)c1F
InChi:	InChI=1S/C6HF5/c7-2-1-3(8)5(10)6(11)4(2)9/h1H
Definition date:	2008-07-11
Last modified:	2011-06-04
Identifier:	1,2,3,4,5-pentafluorobenzene

FB1

FB1
Name:	2-CHLOROBENZENESULFONAMIDE
Formula:	C6 H6 Cl N O2 S
SMILES:	O=S(=O)(c1ccccc1Cl)N
InChi:	InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)
Definition date:	2009-03-31
Last modified:	2011-06-04
Identifier:	2-chlorobenzenesulfonamide

FB2

FB2
Name:	benzenesulfonamide
Formula:	C6 H7 N O2 S
SMILES:	O=S(=O)(N)c1ccccc1
InChi:	InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9)
Definition date:	2009-03-31
Last modified:	2011-06-04
Identifier:	benzenesulfonamide

FBT

FBT
Name:	2,6-DIFLUOROBENZENESULFONAMIDE
Formula:	C6 H5 F2 N O2 S
SMILES:	O=S(=O)(c1c(F)cccc1F)N
InChi:	InChI=1S/C6H5F2NO2S/c7-4-2-1-3-5(8)6(4)12(9,10)11/h1-3H,(H2,9,10,11)
Definition date:	2001-04-16
Last modified:	2011-06-04
Identifier:	2,6-difluorobenzenesulfonamide

FBU

FBU
Name:	3,5-DIFLUOROBENZENESULFONAMIDE
Formula:	C6 H5 F2 N O2 S
SMILES:	Fc1cc(cc(F)c1)S(=O)(=O)N
InChi:	InChI=1S/C6H5F2NO2S/c7-4-1-5(8)3-6(2-4)12(9,10)11/h1-3H,(H2,9,10,11)
Definition date:	2001-04-16
Last modified:	2011-06-04
Identifier:	3,5-difluorobenzenesulfonamide

FBV

FBV
Name:	2-fluorobenzenesulfonamide
Formula:	C6 H6 F N O2 S
SMILES:	O=S(=O)(c1ccccc1F)N
InChi:	InChI=1S/C6H6FNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)
Definition date:	2009-03-31
Last modified:	2011-06-04
Identifier:	2-fluorobenzenesulfonamide

FBW

FBW
Name:	3-fluorobenzenesulfonamide
Formula:	C6 H6 F N O2 S
SMILES:	O=S(=O)(c1cc(F)ccc1)N
InChi:	InChI=1S/C6H6FNO2S/c7-5-2-1-3-6(4-5)11(8,9)10/h1-4H,(H2,8,9,10)
Definition date:	2009-04-01
Last modified:	2011-06-04
Identifier:	3-fluorobenzenesulfonamide

FD3

FD3
Name:	N-ALPHA-(2-NAPHTHYLSULFONYL)-3-AMIDINO-L-PHENYLALANINE PIPERAZIDE
Formula:	C24 H27 N5 O3 S
SMILES:	O=C(N1CCNCC1)C(NS(=O)(=O)c3cc2ccccc2cc3)Cc4cc(C(=[N@H])N)ccc4
InChi:	InChI=1S/C24H27N5O3S/c25-23(26)20-7-3-4-17(14-20)15-22(24(30)29-12-10-27-11-13-29)28-33(31,32)21-9-8-18-5-1-2-6-19(18)16-21/h1-9,14,16,22,27-28H,10-13,15H2,(H3,25,26)/t22-/m0/s1
Definition date:	2001-10-19
Last modified:	2011-06-04
Identifier:	3-{(2S)-2-[(naphthalen-2-ylsulfonyl)amino]-3-oxo-3-piperazin-1-ylpropyl}benzenecarboximidamide

FD4

FD4
Name:	N-ALPHA-(2-NAPHTHYLSULFONYL)-N(3-AMIDINO-L-PHENYLALANINYL)-4-ACETYL-PIPERAZINE
Formula:	C26 H29 N5 O4 S
SMILES:	O=C(N4CCN(C(=O)C(NS(=O)(=O)c2cc1ccccc1cc2)Cc3cc(C(=[N@H])N)ccc3)CC4)C
InChi:	InChI=1S/C26H29N5O4S/c1-18(32)30-11-13-31(14-12-30)26(33)24(16-19-5-4-8-22(15-19)25(27)28)29-36(34,35)23-10-9-20-6-2-3-7-21(20)17-23/h2-10,15,17,24,29H,11-14,16H2,1H3,(H3,27,28)/t24-/m0/s1
Definition date:	2001-10-19
Last modified:	2011-06-04
Identifier:	3-{(2S)-3-(4-acetylpiperazin-1-yl)-2-[(naphthalen-2-ylsulfonyl)amino]-3-oxopropyl}benzenecarboximidamide

FEP

FEP
Name:	[(4-{4-[4-(DIFLUORO-PHOSPHONO-METHYL)-PHENYL]-BUTYL}-PHENYL)-DIFLUORO-METHYL]-PHOSPHONIC ACID
Formula:	C18 H20 F4 O6 P2
SMILES:	FC(F)(c1ccc(cc1)CCCCc2ccc(cc2)C(F)(F)P(=O)(O)O)P(=O)(O)O
InChi:	InChI=1S/C18H20F4O6P2/c19-17(20,29(23,24)25)15-9-5-13(6-10-15)3-1-2-4-14-7-11-16(12-8-14)18(21,22)30(26,27)28/h5-12H,1-4H2,(H2,23,24,25)(H2,26,27,28)
Definition date:	2001-11-06
Last modified:	2011-06-04
Identifier:	{butane-1,4-diylbis[benzene-4,1-diyl(difluoromethanediyl)]}bis(phosphonic acid)

DID

DID
Name:	4,4'[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDE
Formula:	C20 H26 N4 O2
SMILES:	O(c1ccc(cc1)C(=[N@H])N)CCCCCCOc2ccc(C(=[N@H])N)cc2
InChi:	InChI=1S/C20H26N4O2/c21-19(22)15-5-9-17(10-6-15)25-13-3-1-2-4-14-26-18-11-7-16(8-12-18)20(23)24/h5-12H,1-4,13-14H2,(H3,21,22)(H3,23,24)
Definition date:	2003-12-17
Last modified:	2011-06-04
Identifier:	4,4'-[hexane-1,6-diylbis(oxy)]dibenzenecarboximidamide

DJZ

DJZ
Name:	3,5-dimethyl-4-{[2-({1-[4-(methylsulfonyl)benzyl]piperidin-4-yl}amino)pyrimidin-4-yl]oxy}benzonitrile
Formula:	C26 H29 N5 O3 S
SMILES:	N#Cc4cc(c(Oc1nc(ncc1)NC3CCN(Cc2ccc(cc2)S(=O)(=O)C)CC3)c(c4)C)C
InChi:	InChI=1S/C26H29N5O3S/c1-18-14-21(16-27)15-19(2)25(18)34-24-8-11-28-26(30-24)29-22-9-12-31(13-10-22)17-20-4-6-23(7-5-20)35(3,32)33/h4-8,11,14-15,22H,9-10,12-13,17H2,1-3H3,(H,28,29,30)
Definition date:	2010-03-19
Last modified:	2011-06-04
Identifier:	3,5-dimethyl-4-{[2-({1-[4-(methylsulfonyl)benzyl]piperidin-4-yl}amino)pyrimidin-4-yl]oxy}benzonitrile

DMB

DMB
Name:	2-((3',5'-DIMETHYL-4'-HYDROXYPHENYL)AZO)BENZOIC ACID
Formula:	C15 H14 N2 O3
SMILES:	O=C(O)c2ccccc2/N=N/c1cc(c(O)c(c1)C)C
InChi:	InChI=1S/C15H14N2O3/c1-9-7-11(8-10(2)14(9)18)16-17-13-6-4-3-5-12(13)15(19)20/h3-8,18H,1-2H3,(H,19,20)/b17-16+
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	2-[(E)-(4-hydroxy-3,5-dimethylphenyl)diazenyl]benzoic acid

DNC

DNC
Name:	3,5-DINITROCATECHOL
Formula:	C6 H4 N2 O6
SMILES:	[O-][N+](=O)c1cc([N+]([O-])=O)cc(O)c1O
InChi:	InChI=1S/C6H4N2O6/c9-5-2-3(7(11)12)1-4(6(5)10)8(13)14/h1-2,9-10H
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	3,5-dinitrobenzene-1,2-diol

DPS

DPS
Name:	3-(1H-INDOL-3-YL)-2-[4-(4-PHENYL-PIPERIDIN-1-YL)-BENZENESULFONYLAMINO]-PROPIONIC ACID
Formula:	C28 H29 N3 O4 S
SMILES:	O=C(O)C(NS(=O)(=O)c1ccc(cc1)N3CCC(c2ccccc2)CC3)Cc5c4ccccc4nc5
InChi:	InChI=1S/C28H29N3O4S/c32-28(33)27(18-22-19-29-26-9-5-4-8-25(22)26)30-36(34,35)24-12-10-23(11-13-24)31-16-14-21(15-17-31)20-6-2-1-3-7-20/h1-13,19,21,27,29-30H,14-18H2,(H,32,33)/t27-/m0/s1
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	N-{[4-(4-phenylpiperidin-1-yl)phenyl]sulfonyl}-L-tryptophan

DT1

DT1
Name:	4-{[5-(CYCLOHEXYLMETHOXY)[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-YL]AMINO}BENZENESULFONAMIDE
Formula:	C18 H22 N6 O3 S
SMILES:	O=S(=O)(N)c1ccc(cc1)Nc2cc(nc3ncnn23)OCC4CCCCC4
InChi:	InChI=1S/C18H22N6O3S/c19-28(25,26)15-8-6-14(7-9-15)22-16-10-17(23-18-20-12-21-24(16)18)27-11-13-4-2-1-3-5-13/h6-10,12-13,22H,1-5,11H2,(H2,19,25,26)
Definition date:	2005-11-10
Last modified:	2011-06-04
Identifier:	4-{[5-(cyclohexylmethoxy)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzenesulfonamide

DT2

DT2
Name:	4-{[5-(CYCLOHEXYLAMINO)[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-YL]AMINO}BENZENESULFONAMIDE
Formula:	C17 H21 N7 O2 S
SMILES:	O=S(=O)(N)c1ccc(cc1)Nc2cc(nc3ncnn23)NC4CCCCC4
InChi:	InChI=1S/C17H21N7O2S/c18-27(25,26)14-8-6-13(7-9-14)22-16-10-15(21-12-4-2-1-3-5-12)23-17-19-11-20-24(16)17/h6-12,22H,1-5H2,(H2,18,25,26)(H,19,20,21,23)
Definition date:	2005-11-10
Last modified:	2011-06-04
Identifier:	4-{[5-(cyclohexylamino)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzenesulfonamide

DT4

DT4
Name:	4-({5-[(4-AMINOCYCLOHEXYL)AMINO][1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-YL}AMINO)BENZENESULFONAMIDE
Formula:	C17 H22 N8 O2 S
SMILES:	O=S(=O)(N)c1ccc(cc1)Nc2cc(nc3ncnn23)NC4CCC(N)CC4
InChi:	InChI=1S/C17H22N8O2S/c18-11-1-3-12(4-2-11)22-15-9-16(25-17(24-15)20-10-21-25)23-13-5-7-14(8-6-13)28(19,26)27/h5-12,23H,1-4,18H2,(H2,19,26,27)(H,20,21,22,24)/t11-,12-
Definition date:	2005-11-10
Last modified:	2011-06-04
Identifier:	4-({5-[(trans-4-aminocyclohexyl)amino][1,2,4]triazolo[1,5-a]pyrimidin-7-yl}amino)benzenesulfonamide

DT5

DT5
Name:	4-{[5-(CYCLOHEXYLOXY)[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-YL]AMINO}BENZENESULFONAMIDE
Formula:	C17 H20 N6 O3 S
SMILES:	O=S(=O)(N)c1ccc(cc1)Nc2cc(nc3ncnn23)OC4CCCCC4
InChi:	InChI=1S/C17H20N6O3S/c18-27(24,25)14-8-6-12(7-9-14)21-15-10-16(22-17-19-11-20-23(15)17)26-13-4-2-1-3-5-13/h6-11,13,21H,1-5H2,(H2,18,24,25)
Definition date:	2005-11-10
Last modified:	2011-06-04
Identifier:	4-{[5-(cyclohexyloxy)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzenesulfonamide

FRP

FRP
Name:	N1-((2S,3S,5R)-3-AMINO-6-(4-FLUOROPHENYLAMINO)-5-METHYL-6-OXO-1-PHENYLHEXAN-2-YL)-N3,N3-DIPROPYLISOPHTHALAMIDE
Formula:	C33 H41 F N4 O3
SMILES:	Fc3ccc(NC(=O)C(C)CC(N)C(NC(=O)c1cccc(C(=O)N(CCC)CCC)c1)Cc2ccccc2)cc3
InChi:	InChI=1S/C33H41FN4O3/c1-4-18-38(19-5-2)33(41)26-13-9-12-25(22-26)32(40)37-30(21-24-10-7-6-8-11-24)29(35)20-23(3)31(39)36-28-16-14-27(34)15-17-28/h6-17,22-23,29-30H,4-5,18-21,35H2,1-3H3,(H,36,39)(H,37,40)/t23-,29+,30+/m1/s1
Definition date:	2005-12-30
Last modified:	2011-06-04
Identifier:	N'-{(1S,2S,4R)-2-amino-1-benzyl-5-[(4-fluorophenyl)amino]-4-methyl-5-oxopentyl}-N,N-dipropylbenzene-1,3-dicarboxamide

<66 67 68 69 70 71 72 73 74 75 76 777879 80 81 >

224931

數據於2024-09-11公開中

PDB statistics

PDBj update info

Contact PDBj

numon