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: 35455 results BIRD

CKX

CKX
Name:	(2~{S},3~{S},4~{R},5~{R})-4,5-bis(oxidanyl)-2-propyl-piperidine-3-carboxylic acid
Formula:	C9 H17 N O4
SMILES:	CCC[CH]1NC[CH](O)[CH](O)[CH]1C(O)=O
InChi:	InChI=1S/C9H17NO4/c1-2-3-5-7(9(13)14)8(12)6(11)4-10-5/h5-8,10-12H,2-4H2,1H3,(H,13,14)/t5-,6+,7-,8-/m0/s1
Definition date:	2019-05-09
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	(2~{S},3~{S},4~{R},5~{R})-4,5-bis(oxidanyl)-2-propyl-piperidine-3-carboxylic acid

UPD

UPD
Name:	1-acetyl-N-(6-methoxypyridin-3-yl)piperidine-4-carboxamide
Formula:	C14 H19 N3 O3
SMILES:	N(c1cnc(cc1)OC)C(C2CCN(C(C)=O)CC2)=O
InChi:	InChI=1S/C14H19N3O3/c1-10(18)17-7-5-11(6-8-17)14(19)16-12-3-4-13(20-2)15-9-12/h3-4,9,11H,5-8H2,1-2H3,(H,16,19)
Definition date:	2020-05-26
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	1-acetyl-N-(6-methoxypyridin-3-yl)piperidine-4-carboxamide

UPJ

UPJ
Name:	1-acetyl-N-methyl-N-phenylpiperidine-4-carboxamide
Formula:	C15 H20 N2 O2
SMILES:	N(c1ccccc1)(C)C(C2CCN(C(C)=O)CC2)=O
InChi:	InChI=1S/C15H20N2O2/c1-12(18)17-10-8-13(9-11-17)15(19)16(2)14-6-4-3-5-7-14/h3-7,13H,8-11H2,1-2H3
Definition date:	2020-05-26
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	1-acetyl-N-methyl-N-phenylpiperidine-4-carboxamide

UQJ

UQJ
Name:	3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide
Formula:	C6 H7 F2 N3 O
SMILES:	NC(=O)c1c(C(F)F)nn(c1)C
InChi:	InChI=1S/C6H7F2N3O/c1-11-2-3(6(9)12)4(10-11)5(7)8/h2,5H,1H3,(H2,9,12)
Definition date:	2020-05-27
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide

UQM

UQM
Name:	N-[4-(2-amino-2-oxoethyl)phenyl]acetamide
Formula:	C10 H12 N2 O2
SMILES:	NC(Cc1ccc(NC(C)=O)cc1)=O
InChi:	InChI=1S/C10H12N2O2/c1-7(13)12-9-4-2-8(3-5-9)6-10(11)14/h2-5H,6H2,1H3,(H2,11,14)(H,12,13)
Definition date:	2020-05-27
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	N-[4-(2-amino-2-oxoethyl)phenyl]acetamide

UQS

UQS
Name:	N-[(2-fluorophenyl)methyl]-1H-pyrazol-4-amine
Formula:	C10 H10 F N3
SMILES:	n2ncc(NCc1ccccc1F)c2
InChi:	InChI=1S/C10H10FN3/c11-10-4-2-1-3-8(10)5-12-9-6-13-14-7-9/h1-4,6-7,12H,5H2,(H,13,14)
Definition date:	2020-05-27
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	N-[(2-fluorophenyl)methyl]-1H-pyrazol-4-amine

UQV

UQV
Name:	[2-(acetylamino)phenyl]acetic acid
Formula:	C10 H11 N O3
SMILES:	c1ccc(CC(=O)O)c(NC(C)=O)c1
InChi:	InChI=1S/C10H11NO3/c1-7(12)11-9-5-3-2-4-8(9)6-10(13)14/h2-5H,6H2,1H3,(H,11,12)(H,13,14)
Definition date:	2020-05-27
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	[2-(acetylamino)phenyl]acetic acid

UQY

UQY
Name:	1-(methylamino)cyclopentane-1-carboxamide
Formula:	C7 H14 N2 O
SMILES:	NC(=O)C1(CCCC1)NC
InChi:	InChI=1S/C7H14N2O/c1-9-7(6(8)10)4-2-3-5-7/h9H,2-5H2,1H3,(H2,8,10)
Definition date:	2020-05-27
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	1-(methylamino)cyclopentane-1-carboxamide

UR1

UR1
Name:	3-fluoro-5-methylbenzene-1-sulfonamide
Formula:	C7 H8 F N O2 S
SMILES:	c1c(S(N)(=O)=O)cc(C)cc1F
InChi:	InChI=1S/C7H8FNO2S/c1-5-2-6(8)4-7(3-5)12(9,10)11/h2-4H,1H3,(H2,9,10,11)
Definition date:	2020-05-27
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	3-fluoro-5-methylbenzene-1-sulfonamide

UR4

UR4
Name:	2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)acetamide
Formula:	C12 H12 N2 O2 S
SMILES:	n1c(csc1NC(COC)=O)c2ccccc2
InChi:	InChI=1S/C12H12N2O2S/c1-16-7-11(15)14-12-13-10(8-17-12)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,13,14,15)
Definition date:	2020-05-27
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)acetamide

UR7

UR7
Name:	1-(3-fluoro-4-methylphenyl)methanesulfonamide
Formula:	C8 H10 F N O2 S
SMILES:	c1(cc(F)c(C)cc1)CS(N)(=O)=O
InChi:	InChI=1S/C8H10FNO2S/c1-6-2-3-7(4-8(6)9)5-13(10,11)12/h2-4H,5H2,1H3,(H2,10,11,12)
Definition date:	2020-05-27
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	1-(3-fluoro-4-methylphenyl)methanesulfonamide

US7

US7
Name:	1-[4-(methylsulfonyl)phenyl]piperazine
Formula:	C11 H16 N2 O2 S
SMILES:	N2CCN(c1ccc(S(=O)(C)=O)cc1)CC2
InChi:	InChI=1S/C11H16N2O2S/c1-16(14,15)11-4-2-10(3-5-11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
Definition date:	2020-05-28
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	1-[4-(methylsulfonyl)phenyl]piperazine

USA

USA
Name:	(E)-1-(1H-imidazol-2-yl)methanimine
Formula:	C4 H5 N3
SMILES:	n1ccnc1/C=N
InChi:	InChI=1S/C4H5N3/c5-3-4-6-1-2-7-4/h1-3,5H,(H,6,7)/b5-3+
Definition date:	2020-05-28
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	(E)-1-(1H-imidazol-2-yl)methanimine

USD

USD
Name:	(E)-1-(pyrimidin-2-yl)methanimine
Formula:	C5 H5 N3
SMILES:	n1cccnc1/C=N
InChi:	InChI=1S/C5H5N3/c6-4-5-7-2-1-3-8-5/h1-4,6H/b6-4+
Definition date:	2020-05-28
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	(E)-1-(pyrimidin-2-yl)methanimine

USJ

USJ
Name:	(1S,3S)-2-methyl-2,3-dihydro-1H-isoindole-1,3-diol
Formula:	C9 H11 N O2
SMILES:	c1cc2c(cc1)C(N(C2O)C)O
InChi:	InChI=1S/C9H11NO2/c1-10-8(11)6-4-2-3-5-7(6)9(10)12/h2-5,8-9,11-12H,1H3/t8-,9-/m0/s1
Definition date:	2020-05-29
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	(1S,3S)-2-methyl-2,3-dihydro-1H-isoindole-1,3-diol

USP

USP
Name:	(2R)-6-amino-3-methyl-2,3-dihydro-1,3-benzoxazol-2-ol
Formula:	C8 H10 N2 O2
SMILES:	c1(ccc2c(c1)OC(O)N2C)N
InChi:	InChI=1S/C8H10N2O2/c1-10-6-3-2-5(9)4-7(6)12-8(10)11/h2-4,8,11H,9H2,1H3/t8-/m1/s1
Definition date:	2020-05-29
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	(2R)-6-amino-3-methyl-2,3-dihydro-1,3-benzoxazol-2-ol

VSK

VSK
Name:	(2~{S})-2-azanyl-3-(1~{H}-indol-3-yl)-~{N}-[2-(2,4,6-trimethylphenyl)ethyl]propanamide
Formula:	C22 H27 N3 O
SMILES:	Cc1cc(C)c(CCNC(=O)[CH](N)Cc2c[nH]c3ccccc23)c(C)c1
InChi:	InChI=1S/C22H27N3O/c1-14-10-15(2)18(16(3)11-14)8-9-24-22(26)20(23)12-17-13-25-21-7-5-4-6-19(17)21/h4-7,10-11,13,20,25H,8-9,12,23H2,1-3H3,(H,24,26)/t20-/m0/s1
Synonyms:	VSK-B24
Definition date:	2017-07-21
Last modified:	2020-06-05
Release date:	2018-09-12
Identifier:	(2~{S})-2-azanyl-3-(1~{H}-indol-3-yl)-~{N}-[2-(2,4,6-trimethylphenyl)ethyl]propanamide

P1W

P1W
Name:	3-methylbut-2-en-1-ol
Formula:	C5 H10 O
SMILES:	CC(C)=CCO
InChi:	InChI=1S/C5H10O/c1-5(2)3-4-6/h3,6H,4H2,1-2H3
Definition date:	2020-04-14
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	3-methylbut-2-en-1-ol

T9S

T9S
Name:	ethyl 1,3-dihydro-2H-pyrrolo[3,4-c]pyridine-2-carboxylate
Formula:	C10 H12 N2 O2
SMILES:	c21CN(Cc1cncc2)C(=O)OCC
InChi:	InChI=1S/C10H12N2O2/c1-2-14-10(13)12-6-8-3-4-11-5-9(8)7-12/h3-5H,2,6-7H2,1H3
Definition date:	2020-03-18
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	ethyl 1,3-dihydro-2H-pyrrolo[3,4-c]pyridine-2-carboxylate

T9V

T9V
Name:	N-(4-methoxyphenyl)acetamide
Formula:	C9 H11 N O2
SMILES:	c1cc(ccc1OC)NC(=O)C
InChi:	InChI=1S/C9H11NO2/c1-7(11)10-8-3-5-9(12-2)6-4-8/h3-6H,1-2H3,(H,10,11)
Definition date:	2020-03-18
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	N-(4-methoxyphenyl)acetamide

T9Y

T9Y
Name:	ethyl 5-(trifluoromethyl)-1H-pyrazole-4-carboxylate
Formula:	C7 H7 F3 N2 O2
SMILES:	c1c(c(C(F)(F)F)nn1)C(OCC)=O
InChi:	InChI=1S/C7H7F3N2O2/c1-2-14-6(13)4-3-11-12-5(4)7(8,9)10/h3H,2H2,1H3,(H,11,12)
Definition date:	2020-03-18
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	ethyl 5-(trifluoromethyl)-1H-pyrazole-4-carboxylate

EUL

EUL
Name:	2-bromanyl-N-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)benzamide
Formula:	C17 H14 Br N3 O S
SMILES:	Brc1ccccc1C(=O)Nc2ncnc3sc4CCCCc4c23
InChi:	InChI=1S/C17H14BrN3OS/c18-12-7-3-1-5-10(12)16(22)21-15-14-11-6-2-4-8-13(11)23-17(14)20-9-19-15/h1,3,5,7,9H,2,4,6,8H2,(H,19,20,21,22)
Definition date:	2020-01-28
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	2-bromanyl-~{N}-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)benzamide

EYO

EYO
Name:	1,4,7,10,13-pentaoxacyclopentadecane
Formula:	C10 H20 O5
SMILES:	C1COCCOCCOCCOCCO1
InChi:	InChI=1S/C10H20O5/c1-2-12-5-6-14-9-10-15-8-7-13-4-3-11-1/h1-10H2
Definition date:	2020-02-21
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	1,4,7,10,13-pentaoxacyclopentadecane

NTQ

NTQ
Name:	(1~{S})-2,2-bis(fluoranyl)-~{N}-[4-(3-methyl-6-oxidanylidene-2,7-dihydropyrazolo[3,4-b]pyridin-4-yl)cyclohexyl]cyclopropane-1-carboxamide
Formula:	C17 H20 F2 N4 O2
SMILES:	Cc1[nH]nc2NC(=O)C=C([CH]3CC[CH](CC3)NC(=O)[CH]4CC4(F)F)c12
InChi:	InChI=1S/C17H20F2N4O2/c1-8-14-11(6-13(24)21-15(14)23-22-8)9-2-4-10(5-3-9)20-16(25)12-7-17(12,18)19/h6,9-10,12H,2-5,7H2,1H3,(H,20,25)(H2,21,22,23,24)/t9-,10-,12-/m0/s1
Definition date:	2019-12-13
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	(1~{S})-2,2-bis(fluoranyl)-~{N}-[4-(3-methyl-6-oxidanylidene-2,7-dihydropyrazolo[3,4-b]pyridin-4-yl)cyclohexyl]cyclopropane-1-carboxamide

NTW

NTW
Name:	2-[4-(3-methyl-6-oxidanylidene-1,7-dihydropyrazolo[3,4-b]pyridin-4-yl)cyclohexyl]ethanenitrile
Formula:	C15 H18 N4 O
SMILES:	Cc1n[nH]c2NC(=O)C=C([CH]3CC[CH](CC3)CC#N)c12
InChi:	InChI=1S/C15H18N4O/c1-9-14-12(8-13(20)17-15(14)19-18-9)11-4-2-10(3-5-11)6-7-16/h8,10-11H,2-6H2,1H3,(H2,17,18,19,20)/t10-,11-
Definition date:	2019-12-13
Last modified:	2020-06-05
Release date:	2020-06-10
Identifier:	2-[4-(3-methyl-6-oxidanylidene-1,7-dihydropyrazolo[3,4-b]pyridin-4-yl)cyclohexyl]ethanenitrile

<662 663 664 665 666 667 668669670 671 672 673 674 675 676 677 >

224572

건을2024-09-04부터공개중

PDB statistics

PDBj update info

Contact PDBj

numon