Chemie Search results for query - 일본 단백질구조 데이터 뱅크

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: 35294 results BIRD

Q4E

Q4E
Name:	3-[(2-~{tert}-butyl-1,3-thiazol-4-yl)methyl]-6-chloranyl-quinazolin-4-one
Formula:	C16 H16 Cl N3 O S
SMILES:	CC(C)(C)c1scc(CN2C=Nc3ccc(Cl)cc3C2=O)n1
InChi:	InChI=1S/C16H16ClN3OS/c1-16(2,3)15-19-11(8-22-15)7-20-9-18-13-5-4-10(17)6-12(13)14(20)21/h4-6,8-9H,7H2,1-3H3
Definition date:	2020-05-07
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	3-[(2-~{tert}-butyl-1,3-thiazol-4-yl)methyl]-6-chloranyl-quinazolin-4-one

LN4

LN4
Name:	1-[2-fluoranyl-5-(trifluoromethyl)phenyl]-3-[4-[methyl-[2-[(3-sulfamoylphenyl)amino]pyrimidin-4-yl]amino]phenyl]urea
Formula:	C25 H21 F4 N7 O3 S
SMILES:	CN(c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1)c3ccnc(Nc4cccc(c4)[S](N)(=O)=O)n3
InChi:	InChI=1S/C25H21F4N7O3S/c1-36(22-11-12-31-23(35-22)32-17-3-2-4-19(14-17)40(30,38)39)18-8-6-16(7-9-18)33-24(37)34-21-13-15(25(27,28)29)5-10-20(21)26/h2-14H,1H3,(H2,30,38,39)(H,31,32,35)(H2,33,34,37)
Definition date:	2019-03-05
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	1-[2-fluoranyl-5-(trifluoromethyl)phenyl]-3-[4-[methyl-[2-[(3-sulfamoylphenyl)amino]pyrimidin-4-yl]amino]phenyl]urea

Q4T

Q4T
Name:	2-[2-[[3-[4-chloranyl-2-fluoranyl-5-[(3~{R})-piperidin-3-yl]oxy-phenyl]-2-fluoranyl-phenyl]carbonylamino]-5-fluoranyl-phenyl]ethanoic acid
Formula:	C26 H22 Cl F3 N2 O4
SMILES:	OC(=O)Cc1cc(F)ccc1NC(=O)c2cccc(c2F)c3cc(O[CH]4CCCNC4)c(Cl)cc3F
InChi:	InChI=1S/C26H22ClF3N2O4/c27-20-12-21(29)19(11-23(20)36-16-3-2-8-31-13-16)17-4-1-5-18(25(17)30)26(35)32-22-7-6-15(28)9-14(22)10-24(33)34/h1,4-7,9,11-12,16,31H,2-3,8,10,13H2,(H,32,35)(H,33,34)/t16-/m1/s1
Definition date:	2020-05-11
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	2-[2-[[3-[4-chloranyl-2-fluoranyl-5-[(3~{R})-piperidin-3-yl]oxy-phenyl]-2-fluoranyl-phenyl]carbonylamino]-5-fluoranyl-phenyl]ethanoic acid

Q4W

Q4W
Name:	6-chloranyl-3-[(2-propan-2-yl-2,3-dihydro-1,3-thiazol-4-yl)methyl]quinazolin-4-one
Formula:	C15 H16 Cl N3 O S
SMILES:	CC(C)[CH]1NC(=CS1)CN2C=Nc3ccc(Cl)cc3C2=O
InChi:	InChI=1S/C15H16ClN3OS/c1-9(2)14-18-11(7-21-14)6-19-8-17-13-4-3-10(16)5-12(13)15(19)20/h3-5,7-9,14,18H,6H2,1-2H3/t14-/m0/s1
Definition date:	2020-05-12
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	6-chloranyl-3-[(2-propan-2-yl-2,3-dihydro-1,3-thiazol-4-yl)methyl]quinazolin-4-one

Q6H

Q6H
Name:	5-fluoranyl-~{N}-(3-morpholin-4-ylcarbonylphenyl)-2-selanyl-benzamide
Formula:	C18 H17 F N2 O3 Se
SMILES:	Fc1ccc([SeH])c(c1)C(=O)Nc2cccc(c2)C(=O)N3CCOCC3
InChi:	InChI=1S/C18H17FN2O3Se/c19-13-4-5-16(25)15(11-13)17(22)20-14-3-1-2-12(10-14)18(23)21-6-8-24-9-7-21/h1-5,10-11,25H,6-9H2,(H,20,22)
Definition date:	2020-05-22
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	5-fluoranyl-~{N}-(3-morpholin-4-ylcarbonylphenyl)-2-selanyl-benzamide

Q7N

Q7N
Name:	~{N}-[(3-methoxyphenyl)methyl]-2-selanyl-benzamide
Formula:	C15 H15 N O2 Se
SMILES:	COc1cccc(CNC(=O)c2ccccc2[SeH])c1
InChi:	InChI=1S/C15H15NO2Se/c1-18-12-6-4-5-11(9-12)10-16-15(17)13-7-2-3-8-14(13)19/h2-9,19H,10H2,1H3,(H,16,17)
Definition date:	2020-05-26
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	~{N}-[(3-methoxyphenyl)methyl]-2-selanyl-benzamide

Q7T

Q7T
Name:	~{N}-(phenylmethyl)-2-selanyl-benzamide
Formula:	C14 H13 N O Se
SMILES:	[SeH]c1ccccc1C(=O)NCc2ccccc2
InChi:	InChI=1S/C14H13NOSe/c16-14(12-8-4-5-9-13(12)17)15-10-11-6-2-1-3-7-11/h1-9,17H,10H2,(H,15,16)
Definition date:	2020-05-26
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	~{N}-(phenylmethyl)-2-selanyl-benzamide

Q7W

Q7W
Name:	~{N}-[(3-chlorophenyl)methyl]-2-selanyl-benzamide
Formula:	C14 H12 Cl N O Se
SMILES:	Clc1cccc(CNC(=O)c2ccccc2[SeH])c1
InChi:	InChI=1S/C14H12ClNOSe/c15-11-5-3-4-10(8-11)9-16-14(17)12-6-1-2-7-13(12)18/h1-8,18H,9H2,(H,16,17)
Definition date:	2020-05-26
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	~{N}-[(3-chlorophenyl)methyl]-2-selanyl-benzamide

Q85

Q85
Name:	~{N}-[(4-methoxyphenyl)methyl]-2-selanyl-benzamide
Formula:	C15 H15 N O2 Se
SMILES:	COc1ccc(CNC(=O)c2ccccc2[SeH])cc1
InChi:	InChI=1S/C15H15NO2Se/c1-18-12-8-6-11(7-9-12)10-16-15(17)13-4-2-3-5-14(13)19/h2-9,19H,10H2,1H3,(H,16,17)
Definition date:	2020-05-26
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	~{N}-[(4-methoxyphenyl)methyl]-2-selanyl-benzamide

SNZ

SNZ
Name:	N-(3,4-dihydroxyphenyl)-N'-[2-(3,4-dihydroxyphenyl)ethyl]urea
Formula:	C15 H16 N2 O5
SMILES:	N(c1cc(c(O)cc1)O)C(=O)NCCc2ccc(c(c2)O)O
InChi:	InChI=1S/C15H16N2O5/c18-11-3-1-9(7-13(11)20)5-6-16-15(22)17-10-2-4-12(19)14(21)8-10/h1-4,7-8,18-21H,5-6H2,(H2,16,17,22)
Definition date:	2019-09-19
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	N-(3,4-dihydroxyphenyl)-N'-[2-(3,4-dihydroxyphenyl)ethyl]urea

Q8E

Q8E
Name:	~{N}-[(6-methoxypyridin-3-yl)methyl]-2-selanyl-benzamide
Formula:	C14 H14 N2 O2 Se
SMILES:	COc1ccc(CNC(=O)c2ccccc2[SeH])cn1
InChi:	InChI=1S/C14H14N2O2Se/c1-18-13-7-6-10(8-15-13)9-16-14(17)11-4-2-3-5-12(11)19/h2-8,19H,9H2,1H3,(H,16,17)
Definition date:	2020-05-26
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	~{N}-[(6-methoxypyridin-3-yl)methyl]-2-selanyl-benzamide

Q8H

Q8H
Name:	~{N}-(pyridin-3-ylmethyl)-2-selanyl-benzamide
Formula:	C13 H12 N2 O Se
SMILES:	[SeH]c1ccccc1C(=O)NCc2cccnc2
InChi:	InChI=1S/C13H12N2OSe/c16-13(11-5-1-2-6-12(11)17)15-9-10-4-3-7-14-8-10/h1-8,17H,9H2,(H,15,16)
Definition date:	2020-05-26
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	~{N}-(pyridin-3-ylmethyl)-2-selanyl-benzamide

DY9

DY9
Name:	Fluostatin C
Formula:	C18 H12 O6
SMILES:	C[C]12O[CH]1[CH](O)c3c(cc(O)c4c5c(O)cccc5C(=O)c34)C2=O
InChi:	InChI=1S/C18H12O6/c1-18-16(23)7-5-9(20)12-10-6(3-2-4-8(10)19)14(21)13(12)11(7)15(22)17(18)24-18/h2-5,15,17,19-20,22H,1H3/t15-,17+,18-/m1/s1
Definition date:	2019-09-18
Last modified:	2020-09-11
Release date:	2020-09-16

FJO

FJO
Name:	propane-1,1,1,3-tetrol
Formula:	C3 H8 O4
SMILES:	OCCC(O)(O)O
InChi:	InChI=1S/C3H8O4/c4-2-1-3(5,6)7/h4-7H,1-2H2
Definition date:	2020-05-22
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	propane-1,1,1,3-tetrol

GKF

GKF
Name:	3-iodanyl-1~{H}-indazole-7-carbaldehyde
Formula:	C8 H5 I N2 O
SMILES:	Ic1n[nH]c2c(C=O)cccc12
InChi:	InChI=1S/C8H5IN2O/c9-8-6-3-1-2-5(4-12)7(6)10-11-8/h1-4H,(H,10,11)
Definition date:	2020-09-03
Last modified:	2020-09-11
Release date:	2020-09-16
Identifier:	3-iodanyl-1~{H}-indazole-7-carbaldehyde

106

106
Name:	4-[(2Z)-2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]benzene-1-sulfonamide
Formula:	C14 H11 Br N4 O3 S
SMILES:	N1C(/C(c2cc(ccc12)Br)=NNc3ccc(cc3)S(=O)(=O)N)=O
InChi:	InChI=1S/C14H11BrN4O3S/c15-8-1-6-12-11(7-8)13(14(20)17-12)19-18-9-2-4-10(5-3-9)23(16,21)22/h1-7,18H,(H2,16,21,22)(H,17,19,20)
Definition date:	2000-10-03
Last modified:	2020-09-09
Identifier:	4-[(2Z)-2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]benzene-1-sulfonamide

TZS

TZS
Name:	N-{[1-(6,7-dimethoxy-5,8-dihydroquinazolin-4-yl)piperidin-4-yl]methyl}sulfuric diamide
Formula:	C16 H25 N5 O4 S
SMILES:	c21c(ncnc1CC(OC)=C(C2)OC)N3CCC(CC3)CNS(=O)(N)=O
InChi:	InChI=1S/C16H25N5O4S/c1-24-14-7-12-13(8-15(14)25-2)18-10-19-16(12)21-5-3-11(4-6-21)9-20-26(17,22)23/h10-11,20H,3-9H2,1-2H3,(H2,17,22,23)
Definition date:	2020-04-03
Last modified:	2020-09-04
Release date:	2020-09-09
Identifier:	N-{[1-(6,7-dimethoxy-5,8-dihydroquinazolin-4-yl)piperidin-4-yl]methyl}sulfuric diamide

TZV

TZV
Name:	N-{4-[(7-methoxyquinolin-4-yl)oxy]phenyl}sulfuric diamide
Formula:	C16 H15 N3 O4 S
SMILES:	c1cc(NS(=O)(=O)N)ccc1Oc3c2ccc(OC)cc2ncc3
InChi:	InChI=1S/C16H15N3O4S/c1-22-13-6-7-14-15(10-13)18-9-8-16(14)23-12-4-2-11(3-5-12)19-24(17,20)21/h2-10,19H,1H3,(H2,17,20,21)
Definition date:	2020-04-03
Last modified:	2020-09-04
Release date:	2020-09-09
Identifier:	N-{4-[(7-methoxyquinolin-4-yl)oxy]phenyl}sulfuric diamide

U23

U23
Name:	URIDINE-5'-MONOPHOSPHATE-2',3'-CYCLIC PHOSPHATE
Formula:	C9 H12 N2 O11 P2
SMILES:	N1(C(=O)NC(=O)C=C1)C3C2C(OP(O2)(=O)O)C(O3)COP(=O)(O)O
InChi:	InChI=1S/C9H12N2O11P2/c12-5-1-2-11(9(13)10-5)8-7-6(21-24(17,18)22-7)4(20-8)3-19-23(14,15)16/h1-2,4,6-8H,3H2,(H,17,18)(H,10,12,13)(H2,14,15,16)/t4-,6-,7-,8-/m1/s1
Definition date:	2020-07-31
Last modified:	2020-09-04
Release date:	2020-09-09
Identifier:	[(2S,3aR,4R,6R,6aR)-6-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-2-hydroxy-2-oxotetrahydro-2H-2lambda~5~-furo[3,4-d][1,3,2]dioxaphosphol-4-yl]methyl dihydrogen phosphate

QTH

QTH
Name:	1-[(4-phenylphenyl)methyl]-4-pyrrolidin-1-yl-pyridine
Formula:	C22 H23 N2
SMILES:	C1CCN(C1)c2cc[n+](Cc3ccc(cc3)c4ccccc4)cc2
InChi:	InChI=1S/C22H23N2/c1-2-6-20(7-3-1)21-10-8-19(9-11-21)18-23-16-12-22(13-17-23)24-14-4-5-15-24/h1-3,6-13,16-17H,4-5,14-15,18H2/q+1
Definition date:	2020-08-06
Last modified:	2020-09-04
Release date:	2020-09-09
Identifier:	1-[(4-phenylphenyl)methyl]-4-pyrrolidin-1-yl-pyridin-1-ium

QTK

QTK
Name:	1-(phenylmethyl)-4-pyrrolidin-1-yl-pyridin-1-ium
Formula:	C16 H19 N2
SMILES:	C1CCN(C1)c2cc[n+](Cc3ccccc3)cc2
InChi:	InChI=1S/C16H19N2/c1-2-6-15(7-3-1)14-17-12-8-16(9-13-17)18-10-4-5-11-18/h1-3,6-9,12-13H,4-5,10-11,14H2/q+1
Definition date:	2020-08-07
Last modified:	2020-09-04
Release date:	2020-09-09
Identifier:	1-(phenylmethyl)-4-pyrrolidin-1-yl-pyridin-1-ium

GZ6

GZ6
Name:	Guanidinium
Formula:	C H6 N3
SMILES:	C(N)(N)=[NH2+]
InChi:	InChI=1S/CH5N3/c2-1(3)4/h(H5,2,3,4)/p+1
Definition date:	2020-07-29
Last modified:	2020-09-04
Release date:	2020-09-09
Identifier:	diaminomethaniminium

NKV

NKV
Name:	N-(2-methylpropanoyl)adenosine
Formula:	C14 H19 N5 O5
SMILES:	C3(C(C(n2c1c(c(NC(C(C)C)=O)ncn1)nc2)OC3CO)O)O
InChi:	InChI=1S/C14H19N5O5/c1-6(2)13(23)18-11-8-12(16-4-15-11)19(5-17-8)14-10(22)9(21)7(3-20)24-14/h4-7,9-10,14,20-22H,3H2,1-2H3,(H,15,16,18,23)/t7-,9-,10-,14-/m1/s1
Definition date:	2019-05-17
Last modified:	2020-09-04
Release date:	2020-09-09
Identifier:	N-(2-methylpropanoyl)adenosine

UK1

UK1
Name:	3-{(1S)-1-[5-(2,2-dimethylmorpholin-4-yl)-2-{(4S)-2-(4-fluoro-3,5-dimethylphenyl)-3-[3-(4-fluoro-1-methyl-1H-indazol-5-yl)-2-oxo-2,3-dihydro-1H-imidazol-1-yl]-4-methyl-2,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl}-1H-indol-1-yl]butyl}-1,2,4-oxadiazol-5(4H)-one
Formula:	C47 H49 F2 N11 O5
SMILES:	c1(cc(cc(c1F)C)n7c(c2c(CCN(C2C)C(c5cc3c(ccc(c3)N4CCOC(C4)(C)C)n5C(CCC)C6=NOC(N6)=O)=O)n7)N8C=CN(C8=O)c9c(c%10c(cc9)n(C)nc%10)F)C
InChi:	InChI=1S/C47H49F2N11O5/c1-8-9-37(42-51-45(62)65-53-42)59-34-11-10-30(55-18-19-64-47(5,6)25-55)22-29(34)23-38(59)44(61)56-15-14-33-39(28(56)4)43(60(52-33)31-20-26(2)40(48)27(3)21-31)58-17-16-57(46(58)63)36-13-12-35-32(41(36)49)24-50-54(35)7/h10-13,16-17,20-24,28,37H,8-9,14-15,18-19,25H2,1-7H3,(H,51,53,62)/t28-,37-/m0/s1
Definition date:	2020-05-19
Last modified:	2020-09-04
Release date:	2020-09-09
Identifier:	3-{(1S)-1-[5-(2,2-dimethylmorpholin-4-yl)-2-{(4S)-2-(4-fluoro-3,5-dimethylphenyl)-3-[3-(4-fluoro-1-methyl-1H-indazol-5-yl)-2-oxo-2,3-dihydro-1H-imidazol-1-yl]-4-methyl-2,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl}-1H-indol-1-yl]butyl}-1,2,4-oxadiazol-5(4H)-one

UK4

UK4
Name:	2-[(4-{6-[(4-cyano-2-fluorophenyl)methoxy]pyridin-2-yl}piperidin-1-yl)methyl]-1-{[(2S)-oxetan-2-yl]methyl}-1H-benzimidazole-6-carboxylic acid
Formula:	C31 H30 F N5 O4
SMILES:	C1OC(C1)Cn6c(CN4CCC(c3cccc(OCc2c(cc(cc2)C#N)F)n3)CC4)nc5c6cc(C(O)=O)cc5
InChi:	InChI=1S/C31H30FN5O4/c32-25-14-20(16-33)4-5-23(25)19-41-30-3-1-2-26(35-30)21-8-11-36(12-9-21)18-29-34-27-7-6-22(31(38)39)15-28(27)37(29)17-24-10-13-40-24/h1-7,14-15,21,24H,8-13,17-19H2,(H,38,39)/t24-/m0/s1
Definition date:	2020-05-19
Last modified:	2020-09-04
Release date:	2020-09-09
Identifier:	2-[(4-{6-[(4-cyano-2-fluorophenyl)methoxy]pyridin-2-yl}piperidin-1-yl)methyl]-1-{[(2S)-oxetan-2-yl]methyl}-1H-benzimidazole-6-carboxylic acid

<529 530 531 532 533 534 535536537 538 539 540 541 542 543 544 >

223166

건을2024-07-31부터공개중

PDB statistics

PDBj update info

Contact PDBj

numon