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UUS

UUS
Name:	4-bromo-1-(2-hydroxyethyl)pyridin-2(1H)-one
Formula:	C7 H8 Br N O2
SMILES:	C=1C(Br)=CC(N(C=1)CCO)=O
InChi:	InChI=1S/C7H8BrNO2/c8-6-1-2-9(3-4-10)7(11)5-6/h1-2,5,10H,3-4H2
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	4-bromo-1-(2-hydroxyethyl)pyridin-2(1H)-one

UUV

UUV
Name:	4-bromo-1-(2-methoxyethyl)-1H-pyrazole
Formula:	C6 H9 Br N2 O
SMILES:	n1n(cc(c1)Br)CCOC
InChi:	InChI=1S/C6H9BrN2O/c1-10-3-2-9-5-6(7)4-8-9/h4-5H,2-3H2,1H3
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	4-bromo-1-(2-methoxyethyl)-1H-pyrazole

UUY

UUY
Name:	2-[methyl(pyridin-2-yl)amino]ethan-1-ol
Formula:	C8 H12 N2 O
SMILES:	n1ccccc1N(C)CCO
InChi:	InChI=1S/C8H12N2O/c1-10(6-7-11)8-4-2-3-5-9-8/h2-5,11H,6-7H2,1H3
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	2-[methyl(pyridin-2-yl)amino]ethan-1-ol

UV1

UV1
Name:	6-methoxy-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Formula:	C11 H13 N O2
SMILES:	c2c1NC(CCCc1c(OC)cc2)=O
InChi:	InChI=1S/C11H13NO2/c1-14-10-6-3-5-9-8(10)4-2-7-11(13)12-9/h3,5-6H,2,4,7H2,1H3,(H,12,13)
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	6-methoxy-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one

UV7

UV7
Name:	N-[(1H-pyrazol-4-yl)methyl]acetamide
Formula:	C6 H9 N3 O
SMILES:	n1cc(cn1)CNC(C)=O
InChi:	InChI=1S/C6H9N3O/c1-5(10)7-2-6-3-8-9-4-6/h3-4H,2H2,1H3,(H,7,10)(H,8,9)
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	N-[(1H-pyrazol-4-yl)methyl]acetamide

UVA

UVA
Name:	N-methyl-2-(methylsulfonyl)aniline
Formula:	C8 H11 N O2 S
SMILES:	c1cc(S(C)(=O)=O)c(NC)cc1
InChi:	InChI=1S/C8H11NO2S/c1-9-7-5-3-4-6-8(7)12(2,10)11/h3-6,9H,1-2H3
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	N-methyl-2-(methylsulfonyl)aniline

UVG

UVG
Name:	N,N-dimethyl-1H-pyrazole-4-carboxamide
Formula:	C6 H9 N3 O
SMILES:	n1ncc(c1)C(N(C)C)=O
InChi:	InChI=1S/C6H9N3O/c1-9(2)6(10)5-3-7-8-4-5/h3-4H,1-2H3,(H,7,8)
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	N,N-dimethyl-1H-pyrazole-4-carboxamide

UVJ

UVJ
Name:	3-(2-methyl-1H-benzimidazol-1-yl)propanamide
Formula:	C11 H13 N3 O
SMILES:	n2(c1ccccc1nc2C)CCC(N)=O
InChi:	InChI=1S/C11H13N3O/c1-8-13-9-4-2-3-5-10(9)14(8)7-6-11(12)15/h2-5H,6-7H2,1H3,(H2,12,15)
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	3-(2-methyl-1H-benzimidazol-1-yl)propanamide

UVS

UVS
Name:	5-(methoxymethyl)-1,3,4-thiadiazol-2-amine
Formula:	C4 H7 N3 O S
SMILES:	n1nc(COC)sc1N
InChi:	InChI=1S/C4H7N3OS/c1-8-2-3-6-7-4(5)9-3/h2H2,1H3,(H2,5,7)
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	5-(methoxymethyl)-1,3,4-thiadiazol-2-amine

UVV

UVV
Name:	3-amino-1,6-dimethylpyridin-2(1H)-one
Formula:	C7 H10 N2 O
SMILES:	N1(C(C)=CC=C(C1=O)N)C
InChi:	InChI=1S/C7H10N2O/c1-5-3-4-6(8)7(10)9(5)2/h3-4H,8H2,1-2H3
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	3-amino-1,6-dimethylpyridin-2(1H)-one

UVY

UVY
Name:	2-(1-ethyl-1H-pyrazol-4-yl)ethan-1-ol
Formula:	C7 H12 N2 O
SMILES:	n1cc(CCO)cn1CC
InChi:	InChI=1S/C7H12N2O/c1-2-9-6-7(3-4-10)5-8-9/h5-6,10H,2-4H2,1H3
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	2-(1-ethyl-1H-pyrazol-4-yl)ethan-1-ol

UW7

UW7
Name:	(6S)-1-methyl-4,5,6,7-tetrahydro-1H-benzotriazole-6-carboxylic acid
Formula:	C8 H11 N3 O2
SMILES:	n2n(c1CC(C(O)=O)CCc1n2)C
InChi:	InChI=1S/C8H11N3O2/c1-11-7-4-5(8(12)13)2-3-6(7)9-10-11/h5H,2-4H2,1H3,(H,12,13)/t5-/m0/s1
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	(6S)-1-methyl-4,5,6,7-tetrahydro-1H-benzotriazole-6-carboxylic acid

UWD

UWD
Name:	N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine
Formula:	C8 H10 N4
SMILES:	n2c(n1ccccc1n2)CNC
InChi:	InChI=1S/C8H10N4/c1-9-6-8-11-10-7-4-2-3-5-12(7)8/h2-5,9H,6H2,1H3
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine

UWG

UWG
Name:	(1S)-1-(1-cyclopentyl-1H-pyrazol-4-yl)ethan-1-ol
Formula:	C10 H16 N2 O
SMILES:	n1(cc(C(C)O)cn1)C2CCCC2
InChi:	InChI=1S/C10H16N2O/c1-8(13)9-6-11-12(7-9)10-4-2-3-5-10/h6-8,10,13H,2-5H2,1H3/t8-/m0/s1
Definition date:	2020-06-02
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	(1S)-1-(1-cyclopentyl-1H-pyrazol-4-yl)ethan-1-ol

UWS

UWS
Name:	6-methyl-2-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridazin-3(2H)-one
Formula:	C10 H11 N3 O2
SMILES:	N=2N(Cc1cc(C)no1)C(C=CC=2C)=O
InChi:	InChI=1S/C10H11N3O2/c1-7-3-4-10(14)13(11-7)6-9-5-8(2)12-15-9/h3-5H,6H2,1-2H3
Definition date:	2020-06-03
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	6-methyl-2-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridazin-3(2H)-one

UWV

UWV
Name:	2-fluoro-N-[(1H-pyrazol-3-yl)methyl]aniline
Formula:	C10 H10 F N3
SMILES:	n2nc(CNc1ccccc1F)cc2
InChi:	InChI=1S/C10H10FN3/c11-9-3-1-2-4-10(9)12-7-8-5-6-13-14-8/h1-6,12H,7H2,(H,13,14)
Definition date:	2020-06-03
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	2-fluoro-N-[(1H-pyrazol-3-yl)methyl]aniline

UWY

UWY
Name:	N-(1-ethyl-1H-pyrazol-4-yl)cyclopentanecarboxamide
Formula:	C11 H17 N3 O
SMILES:	N(c1cnn(c1)CC)C(=O)C2CCCC2
InChi:	InChI=1S/C11H17N3O/c1-2-14-8-10(7-12-14)13-11(15)9-5-3-4-6-9/h7-9H,2-6H2,1H3,(H,13,15)
Definition date:	2020-06-03
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	N-(1-ethyl-1H-pyrazol-4-yl)cyclopentanecarboxamide

UX1

UX1
Name:	1-[(2-fluorophenyl)methyl]-N-methylcyclopropane-1-carboxamide
Formula:	C12 H14 F N O
SMILES:	c1(c(cccc1)F)CC2(CC2)C(NC)=O
InChi:	InChI=1S/C12H14FNO/c1-14-11(15)12(6-7-12)8-9-4-2-3-5-10(9)13/h2-5H,6-8H2,1H3,(H,14,15)
Definition date:	2020-06-03
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	1-[(2-fluorophenyl)methyl]-N-methylcyclopropane-1-carboxamide

UX7

UX7
Name:	N-(6-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide
Formula:	C12 H12 N2 O2 S
SMILES:	N(C(=O)C1CC1)c2sc3c(n2)ccc(OC)c3
InChi:	InChI=1S/C12H12N2O2S/c1-16-8-4-5-9-10(6-8)17-12(13-9)14-11(15)7-2-3-7/h4-7H,2-3H2,1H3,(H,13,14,15)
Definition date:	2020-06-03
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	N-(6-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide

UXA

UXA
Name:	~{N}-cyclopropyl-1,3-benzodioxole-5-carboxamide
Formula:	C11 H11 N O3
SMILES:	c1(cc2c(cc1)OCO2)C(NC3CC3)=O
InChi:	InChI=1S/C11H11NO3/c13-11(12-8-2-3-8)7-1-4-9-10(5-7)15-6-14-9/h1,4-5,8H,2-3,6H2,(H,12,13)
Definition date:	2020-06-03
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	N-cyclopropyl-2H-1,3-benzodioxole-5-carboxamide

UXD

UXD
Name:	(1H-pyrazol-4-yl)(pyrrolidin-1-yl)methanone
Formula:	C8 H11 N3 O
SMILES:	n1cc(cn1)C(N2CCCC2)=O
InChi:	InChI=1S/C8H11N3O/c12-8(7-5-9-10-6-7)11-3-1-2-4-11/h5-6H,1-4H2,(H,9,10)
Definition date:	2020-06-03
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	(1H-pyrazol-4-yl)(pyrrolidin-1-yl)methanone

UXG

UXG
Name:	1-(diphenylmethyl)azetidin-3-ol
Formula:	C16 H17 N O
SMILES:	c1(ccccc1)C(c2ccccc2)N3CC(C3)O
InChi:	InChI=1S/C16H17NO/c18-15-11-17(12-15)16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-16,18H,11-12H2
Definition date:	2020-06-03
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	1-(diphenylmethyl)azetidin-3-ol

UXJ

UXJ
Name:	2-fluoro-N-[(3-methyl-1H-pyrazol-4-yl)methyl]aniline
Formula:	C11 H12 F N3
SMILES:	n2cc(CNc1ccccc1F)c(n2)C
InChi:	InChI=1S/C11H12FN3/c1-8-9(7-14-15-8)6-13-11-5-3-2-4-10(11)12/h2-5,7,13H,6H2,1H3,(H,14,15)
Definition date:	2020-06-03
Last modified:	2020-06-12
Release date:	2020-06-17
Identifier:	2-fluoro-N-[(3-methyl-1H-pyrazol-4-yl)methyl]aniline

HEO

HEO
Name:	HEME O
Formula:	C49 H58 Fe N4 O5
SMILES:	[Fe]321N4C5=CC8=[N+]1C(=Cc7n2c(C=C6[N+]3=C(C=C4C(=C5CCC(=O)O)C)C(=C6C(O)CCC=C(/CCC=C(CCC=C(C)C)C)C)C)c(c7C=C)C)C(=C8CCC(=O)O)C
InChi:	InChI=1S/C49H60N4O5.Fe/c1-10-35-31(6)40-26-45-49(46(54)19-13-18-30(5)17-12-16-29(4)15-11-14-28(2)3)34(9)41(53-45)24-38-32(7)36(20-22-47(55)56)43(51-38)27-44-37(21-23-48(57)58)33(8)39(52-44)25-42(35)50-40
Definition date:	2000-09-28
Last modified:	2020-06-11
Identifier:	[3,3'-{7-ethenyl-12-[(1S,4Z,8E)-1-hydroxy-5,9,13-trimethyltetradeca-4,8,12-trien-1-yl]-3,8,13,17-tetramethylporphyrin-2,18-diyl-kappa~4~N~21~,N~22~,N~23~,N~24~}di(propanoato)(2-)]iron(2+)

R3Y

R3Y
Name:	1-{[7-(5-chloro-2-{[(3R,4S)-4-fluoropyrrolidin-3-yl]oxy}-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]methyl}-1H-pyrrole-2,5-dione
Formula:	C23 H21 Cl F N3 O3 S
SMILES:	Cc4cc(Cl)cc(c2ccnc3cc(CN1C(CCC1=O)=O)sc23)c4OC5CNCC5F
InChi:	InChI=1S/C23H21ClFN3O3S/c1-12-6-13(24)7-16(22(12)31-19-10-26-9-17(19)25)15-4-5-27-18-8-14(32-23(15)18)11-28-20(29)2-3-21(28)30/h4-8,17,19,26H,2-3,9-11H2,1H3/t17-,19+/m0/s1
Definition date:	2020-01-29
Last modified:	2020-06-08
Release date:	2020-04-29
Identifier:	1-{[7-(5-chloro-2-{[(3R,4S)-4-fluoropyrrolidin-3-yl]oxy}-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]methyl}pyrrolidine-2,5-dione

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