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RUZ

RUZ
Name:	[(2~{R},3~{S},4~{R},5~{R})-5-[7-azanyl-5-(hydroxymethyl)benzimidazol-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl ~{N}-[(2~{S})-2-azanyl-3-oxidanyl-propanoyl]sulfamate
Formula:	C16 H23 N5 O9 S
SMILES:	N[CH](CO)C(=O)N[S](=O)(=O)OC[CH]1O[CH]([CH](O)[CH]1O)n2cnc3cc(CO)cc(N)c23
InChi:	InChI=1S/C16H23N5O9S/c17-8-1-7(3-22)2-10-12(8)21(6-19-10)16-14(25)13(24)11(30-16)5-29-31(27,28)20-15(26)9(18)4-23/h1-2,6,9,11,13-14,16,22-25H,3-5,17-18H2,(H,20,26)/t9-,11+,13+,14+,16+/m0/s1
Synonyms:	SerS7HMDDA
Definition date:	2020-10-21
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	[(2~{R},3~{S},4~{R},5~{R})-5-[7-azanyl-5-(hydroxymethyl)benzimidazol-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl ~{N}-[(2~{S})-2-azanyl-3-oxidanyl-propanoyl]sulfamate

WHS

WHS
Name:	4-methyl-N-{[(2R)-oxolan-2-yl]methyl}-1,3-thiazol-2-amine
Formula:	C9 H14 N2 O S
SMILES:	n1c(C)csc1NCC2CCCO2
InChi:	InChI=1S/C9H14N2OS/c1-7-6-13-9(11-7)10-5-8-3-2-4-12-8/h6,8H,2-5H2,1H3,(H,10,11)/t8-/m1/s1
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	4-methyl-N-{[(2R)-oxolan-2-yl]methyl}-1,3-thiazol-2-amine

WHV

WHV
Name:	(1S)-1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylethan-1-amine
Formula:	C8 H14 N2 S
SMILES:	n1c(C)c(C(NC)C)sc1C
InChi:	InChI=1S/C8H14N2S/c1-5(9-4)8-6(2)10-7(3)11-8/h5,9H,1-4H3/t5-/m0/s1
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	(1S)-1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylethan-1-amine

WHY

WHY
Name:	4-[(dimethylamino)methyl]benzonitrile
Formula:	C10 H12 N2
SMILES:	N#Cc1ccc(CN(C)C)cc1
InChi:	InChI=1S/C10H12N2/c1-12(2)8-10-5-3-9(7-11)4-6-10/h3-6H,8H2,1-2H3
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	4-[(dimethylamino)methyl]benzonitrile

W0M

W0M
Name:	(2R)-2-(4-chlorophenoxy)propanamide
Formula:	C9 H10 Cl N O2
SMILES:	c1cc(ccc1Cl)OC(C(=O)N)C
InChi:	InChI=1S/C9H10ClNO2/c1-6(9(11)12)13-8-4-2-7(10)3-5-8/h2-6H,1H3,(H2,11,12)/t6-/m1/s1
Definition date:	2020-09-24
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	(2R)-2-(4-chlorophenoxy)propanamide

WJ4

WJ4
Name:	4-[(5-chloro-1,2,3-thiadiazol-4-yl)methyl]morpholine
Formula:	C7 H10 Cl N3 O S
SMILES:	n1c(c(Cl)sn1)CN2CCOCC2
InChi:	InChI=1S/C7H10ClN3OS/c8-7-6(9-10-13-7)5-11-1-3-12-4-2-11/h1-5H2
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	4-[(5-chloro-1,2,3-thiadiazol-4-yl)methyl]morpholine

WJ7

WJ7
Name:	2-bromo-4-fluoro-N,N-dimethylbenzamide
Formula:	C9 H9 Br F N O
SMILES:	c1cc(cc(Br)c1C(N(C)C)=O)F
InChi:	InChI=1S/C9H9BrFNO/c1-12(2)9(13)7-4-3-6(11)5-8(7)10/h3-5H,1-2H3
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	2-bromo-4-fluoro-N,N-dimethylbenzamide

WJA

WJA
Name:	N-methyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
Formula:	C6 H10 N2 O3 S
SMILES:	n1c(CS(NC)(=O)=O)cc(o1)C
InChi:	InChI=1S/C6H10N2O3S/c1-5-3-6(8-11-5)4-12(9,10)7-2/h3,7H,4H2,1-2H3
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	N-methyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide

WJG

WJG
Name:	(S)-1-(4-methoxyphenyl)-1-phenylmethanamine
Formula:	C14 H15 N O
SMILES:	c2(C(N)c1ccccc1)ccc(OC)cc2
InChi:	InChI=1S/C14H15NO/c1-16-13-9-7-12(8-10-13)14(15)11-5-3-2-4-6-11/h2-10,14H,15H2,1H3
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	(S)-1-(4-methoxyphenyl)-1-phenylmethanamine

WJJ

WJJ
Name:	(2R)-3-(4-bromophenyl)-2-methylpropanamide
Formula:	C10 H12 Br N O
SMILES:	c1cc(ccc1CC(C)C(N)=O)Br
InChi:	InChI=1S/C10H12BrNO/c1-7(10(12)13)6-8-2-4-9(11)5-3-8/h2-5,7H,6H2,1H3,(H2,12,13)/t7-/m1/s1
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	(2R)-3-(4-bromophenyl)-2-methylpropanamide

WJM

WJM
Name:	2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide
Formula:	C11 H15 N3 O3
SMILES:	N1(CCN(CC1)C(=O)c2ccco2)CC(N)=O
InChi:	InChI=1S/C11H15N3O3/c12-10(15)8-13-3-5-14(6-4-13)11(16)9-2-1-7-17-9/h1-2,7H,3-6,8H2,(H2,12,15)
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide

WJS

WJS
Name:	(2~{S})-2-$l^{4}-azanyl-3-[[(2~{R})-3-octadecanoyloxy-2-oxidanyl-propoxy]-oxidanyl-oxidanylidene-$l^{6}-phosphanyl]oxy-propanoic acid
Formula:	C24 H20 N O9 P
SMILES:	[C][C][C][C][C][C][C][C][CH][CH][CH][CH][CH][C][C][C][C]C(=O)OC[CH](O)CO[PH](O)(=O)OC[CH]([NH3])C(O)=O
InChi:	InChI=1S/C24H50NO9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(27)32-18-21(26)19-33-35(30,31)34-20-22(25)24(28)29/h21-22,26,35H,2-20H2,1,25H3,(H,28,29)(H,30,31)/t21-,22+/m1/s1
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	(2~{S})-2-$l^{4}-azanyl-3-[[(2~{R})-3-octadecanoyloxy-2-oxidanyl-propoxy]-oxidanyl-oxidanylidene-$l^{6}-phosphanyl]oxy-propanoic acid

WK4

WK4
Name:	2-(1H-imidazol-1-yl)ethyl dimethylcarbamate
Formula:	C8 H13 N3 O2
SMILES:	c1cncn1CCOC(=O)N(C)C
InChi:	InChI=1S/C8H13N3O2/c1-10(2)8(12)13-6-5-11-4-3-9-7-11/h3-4,7H,5-6H2,1-2H3
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	2-(1H-imidazol-1-yl)ethyl dimethylcarbamate

WK7

WK7
Name:	3-fluoro-4-(piperazin-1-yl)benzonitrile
Formula:	C11 H12 F N3
SMILES:	C2N(c1c(F)cc(C#N)cc1)CCNC2
InChi:	InChI=1S/C11H12FN3/c12-10-7-9(8-13)1-2-11(10)15-5-3-14-4-6-15/h1-2,7,14H,3-6H2
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	3-fluoro-4-(piperazin-1-yl)benzonitrile

WKA

WKA
Name:	N-(2,1,3-benzoxadiazol-4-yl)acetamide
Formula:	C8 H7 N3 O2
SMILES:	n2c1c(NC(C)=O)cccc1no2
InChi:	InChI=1S/C8H7N3O2/c1-5(12)9-6-3-2-4-7-8(6)11-13-10-7/h2-4H,1H3,(H,9,12)
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	N-(2,1,3-benzoxadiazol-4-yl)acetamide

WKD

WKD
Name:	(2R)-2-(4-cyanophenoxy)propanamide
Formula:	C10 H10 N2 O2
SMILES:	c1cc(OC(C)C(N)=O)ccc1C#N
InChi:	InChI=1S/C10H10N2O2/c1-7(10(12)13)14-9-4-2-8(6-11)3-5-9/h2-5,7H,1H3,(H2,12,13)/t7-/m1/s1
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	(2R)-2-(4-cyanophenoxy)propanamide

WKG

WKG
Name:	1-(2-azaspiro[5.6]dodecan-2-yl)ethan-1-one
Formula:	C13 H23 N O
SMILES:	C1C2(CCCCC1)CCCN(C(C)=O)C2
InChi:	InChI=1S/C13H23NO/c1-12(15)14-10-6-9-13(11-14)7-4-2-3-5-8-13/h2-11H2,1H3
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	1-(2-azaspiro[5.6]dodecan-2-yl)ethan-1-one

WKJ

WKJ
Name:	(3R)-1-[(4-chlorophenyl)methyl]pyrrolidin-3-ol
Formula:	C11 H14 Cl N O
SMILES:	c2(ccc(CN1CCC(C1)O)cc2)Cl
InChi:	InChI=1S/C11H14ClNO/c12-10-3-1-9(2-4-10)7-13-6-5-11(14)8-13/h1-4,11,14H,5-8H2/t11-/m1/s1
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	(3R)-1-[(4-chlorophenyl)methyl]pyrrolidin-3-ol

WKM

WKM
Name:	(2S)-2-amino-3-methyl-1-(morpholin-4-yl)butan-1-one
Formula:	C9 H18 N2 O2
SMILES:	C1OCCN(C(C(C(C)C)N)=O)C1
InChi:	InChI=1S/C9H18N2O2/c1-7(2)8(10)9(12)11-3-5-13-6-4-11/h7-8H,3-6,10H2,1-2H3/t8-/m0/s1
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	(2S)-2-amino-3-methyl-1-(morpholin-4-yl)butan-1-one

WKP

WKP
Name:	(4-methoxyphenyl)(piperidin-4-yl)methanone
Formula:	C13 H17 N O2
SMILES:	C2NCCC(C(c1ccc(cc1)OC)=O)C2
InChi:	InChI=1S/C13H17NO2/c1-16-12-4-2-10(3-5-12)13(15)11-6-8-14-9-7-11/h2-5,11,14H,6-9H2,1H3
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	(4-methoxyphenyl)(piperidin-4-yl)methanone

WKS

WKS
Name:	2,4-dimethyl-6-(piperazin-1-yl)pyrimidine
Formula:	C10 H16 N4
SMILES:	C1CNCCN1c2cc(C)nc(n2)C
InChi:	InChI=1S/C10H16N4/c1-8-7-10(13-9(2)12-8)14-5-3-11-4-6-14/h7,11H,3-6H2,1-2H3
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	2,4-dimethyl-6-(piperazin-1-yl)pyrimidine

WKV

WKV
Name:	N-[(5-bromo-2-methoxyphenyl)methyl]acetamide
Formula:	C10 H12 Br N O2
SMILES:	C(c1c(OC)ccc(c1)Br)NC(=O)C
InChi:	InChI=1S/C10H12BrNO2/c1-7(13)12-6-8-5-9(11)3-4-10(8)14-2/h3-5H,6H2,1-2H3,(H,12,13)
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	N-[(5-bromo-2-methoxyphenyl)methyl]acetamide

WKY

WKY
Name:	N-(3-methylpyridin-4-yl)acetamide
Formula:	C8 H10 N2 O
SMILES:	c1(cnccc1NC(C)=O)C
InChi:	InChI=1S/C8H10N2O/c1-6-5-9-4-3-8(6)10-7(2)11/h3-5H,1-2H3,(H,9,10,11)
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	N-(3-methylpyridin-4-yl)acetamide

WL1

WL1
Name:	methyl 4-sulfanylbenzoate
Formula:	C8 H8 O2 S
SMILES:	c1c(C(OC)=O)ccc(c1)S
InChi:	InChI=1S/C8H8O2S/c1-10-8(9)6-2-4-7(11)5-3-6/h2-5,11H,1H3
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	methyl 4-sulfanylbenzoate

WL4

WL4
Name:	N-(3-cyanophenyl)-2-methylpropanamide
Formula:	C11 H12 N2 O
SMILES:	c1ccc(NC(C(C)C)=O)cc1C#N
InChi:	InChI=1S/C11H12N2O/c1-8(2)11(14)13-10-5-3-4-9(6-10)7-12/h3-6,8H,1-2H3,(H,13,14)
Definition date:	2020-10-30
Last modified:	2020-11-06
Release date:	2020-11-11
Identifier:	N-(3-cyanophenyl)-2-methylpropanamide

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