sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide

C90H93Cl2N14NaO19 — CID 159300106

IUPACsodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide
SMILESCC1(C)CNC(=O)c2cc3ccc(C(=O)Nc4cccnc4)cc3n21.CC1(C)CNC(=O)c2cc3ccc(C(=O)O)cc3n21.CCOC(=O)c1ccc2cc(C(=O)OCC)n(C(C)(C)C#N)c2c1.CCOC(=O)c1ccc2cc(C(=O)OCC)n(CC#N)c2c1.CCOC(=O)c1ccc2cc3n(c2c1)C(C)(C)CNC3=O.Nc1cccnc1.O=C(Cl)C(=O)Cl.[Na+].[OH-]
InChIInChI=1S/C19H18N4O2.C18H20N2O4.C16H16N2O4.C16H18N2O3.C14H14N2O3.C5H6N2.C2Cl2O2.Na.H2O/c1-19(2)11-21-18(25)16-8-12-5-6-13(9-15(12)23(16)19)17(24)22-14-4-3-7-20-10-14;1-5-23-16(21)13-8-7-12-9-15(17(22)24-6-2)20(14(12)10-13)18(3,4)11-19;1-3-21-15(19)12-6-5-11-9-14(16(20)22-4-2)18(8-7-17)13(11)10-12;1-4-21-15(20)11-6-5-10-7-13-14(19)17-9-16(2,3)18(13)12(10)8-11;1-14(2)7-15-12(17)11-5-8-3-4-9(13(18)19)6-10(8)16(11)14;6-5-2-1-3-7-4-5;3-1(5)2(4)6;;/h3-10H,11H2,1-2H3,(H,21,25)(H,22,24);7-10H,5-6H2,1-4H3;5-6,9-10H,3-4,8H2,1-2H3;5-8H,4,9H2,1-3H3,(H,17,19);3-6H,7H2,1-2H3,(H,15,17)(H,18,19);1-4H,6H2;;;1H2/q;;;;;;;+1;/p-1
InChIKeyLBFLRVVSQKMOCS-UHFFFAOYSA-M
MW1768.71 g/mol
LogP10.66
Rot. Bonds16

About sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide

sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide (PubChem CID 159300106) has the molecular formula C90H93Cl2N14NaO19 and a molecular weight of 1768.71 g/mol. Its IUPAC name is sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide.

Molecular Properties

Compound Namesodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide
PubChem CID159300106
Molecular FormulaC90H93Cl2N14NaO19
Molecular Weight1768.71 g/mol
Exact Mass1766.60
IUPAC Namesodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide
SMILESCC1(C)CNC(=O)c2cc3ccc(C(=O)Nc4cccnc4)cc3n21.CC1(C)CNC(=O)c2cc3ccc(C(=O)O)cc3n21.CCOC(=O)c1ccc2cc(C(=O)OCC)n(C(C)(C)C#N)c2c1.CCOC(=O)c1ccc2cc(C(=O)OCC)n(CC#N)c2c1.CCOC(=O)c1ccc2cc3n(c2c1)C(C)(C)CNC3=O.Nc1cccnc1.O=C(Cl)C(=O)Cl.[Na+].[OH-]
InChIInChI=1S/C19H18N4O2.C18H20N2O4.C16H16N2O4.C16H18N2O3.C14H14N2O3.C5H6N2.C2Cl2O2.Na.H2O/c1-19(2)11-21-18(25)16-8-12-5-6-13(9-15(12)23(16)19)17(24)22-14-4-3-7-20-10-14;1-5-23-16(21)13-8-7-12-9-15(17(22)24-6-2)20(14(12)10-13)18(3,4)11-19;1-3-21-15(19)12-6-5-11-9-14(16(20)22-4-2)18(8-7-17)13(11)10-12;1-4-21-15(20)11-6-5-10-7-13-14(19)17-9-16(2,3)18(13)12(10)8-11;1-14(2)7-15-12(17)11-5-8-3-4-9(13(18)19)6-10(8)16(11)14;6-5-2-1-3-7-4-5;3-1(5)2(4)6;;/h3-10H,11H2,1-2H3,(H,21,25)(H,22,24);7-10H,5-6H2,1-4H3;5-6,9-10H,3-4,8H2,1-2H3;5-8H,4,9H2,1-3H3,(H,17,19);3-6H,7H2,1-2H3,(H,15,17)(H,18,19);1-4H,6H2;;;1H2/q;;;;;;;+1;/p-1
InChIKeyLBFLRVVSQKMOCS-UHFFFAOYSA-M
XLogP10.66
TPSA473.37 Ų
H-Bond Donors6
H-Bond Acceptors28
Rotatable Bonds16
Heavy Atoms126
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001768.71
LogP ≤ 510.66
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1028

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide with MolForge

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Related Compounds

13-cyclohexyl-6-(4-phenylpiperazine-1-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;(E)-3-[4-[[1-[[13-cyclohexyl-6-(piperidine-1-carbonyl)-6,7-dihydro-5H-indolo[2,1-a][2]benzazepine-10-carbonyl]amino]cyclopentanecarbonyl]amino]phenyl]prop-2-enoic acid;13-cyclohexyl-6-(piperidine-1-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 13-cyclohexyl-6-(morpholine-4-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate;methyl 13-cyclohexyl-6-(4-pyridin-4-ylpiperazine-1-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate
CID 157607490
diethyl 1-(1-cyanoethyl)indole-2,6-dicarboxylate;diethyl 1H-indole-2,6-dicarboxylate;ethyl 4-methyl-1-oxo-3,4-dihydro-2H-pyrazino[1,2-a]indole-7-carboxylate;4-methyl-1-oxo-3,4-dihydro-2H-pyrazino[1,2-a]indole-7-carboxylic acid
CID 158153634
bis(4-[(E)-2-(4-methoxycarbonylphenyl)ethenyl]benzoic acid);methyl 3-(1H-indol-3-yl)-2-[[2-[4-[[3-(1H-indol-3-yl)-1-methoxy-1-oxopropan-2-yl]carbamoyl]-2-pyridinyl]pyridine-4-carbonyl]amino]propanoate;bis(2-pyridin-2-ylpyridine);ruthenium
CID 158480461
diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;diethyl 1H-indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate
CID 158547189
(3S,4R)-3,4-dimethyl-1-oxo-3,4-dihydro-2H-pyrazino[1,2-a]indole-7-carboxylic acid;(3R,4S)-3,4-dimethyl-1-oxo-3,4-dihydro-2H-pyrazino[1,2-a]indole-7-carboxylic acid;ethyl (3S,4R)-3,4-dimethyl-1-oxo-3,4-dihydro-2H-pyrazino[1,2-a]indole-7-carboxylate;bis(ethyl (3R,4S)-3,4-dimethyl-1-oxo-3,4-dihydro-2H-pyrazino[1,2-a]indole-7-carboxylate)
CID 158624547
adamantan-1-amine;N-(1-adamantyl)-4-formylbenzamide;bis(2-chloroacetyl chloride);4-formylbenzoic acid;methyl (1R,3R)-1-[4-[2-(1-adamantyl)acetyl]phenyl]-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate;methyl (1S,3R)-1-[4-[2-(1-adamantyl)acetyl]phenyl]-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate;methyl (1R,3R)-1-[4-[2-(1-adamantyl)acetyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate;methyl (1S,3R)-1-[4-[2-(1-adamantyl)acetyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate;methyl (2R)-2-amino-3-(1H-indol-3-yl)propanoate
CID 158892576
N-(2-aminoethyl)-9H-pyrido[3,4-b]indole-3-carboxamide;butyl 9H-pyrido[3,4-b]indole-3-carboxylate;ethyl 9H-pyrido[3,4-b]indole-3-carboxylate;9H-pyrido[3,4-b]indole-3-carboxylic acid
CID 159390411
2-amino-3-(1H-indol-3-yl)propanoic acid;ethyl 1-pyridin-3-yl-9H-pyrido[3,4-b]indole-3-carboxylate;ethyl 1-pyridin-3-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate;1-pyridin-3-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
CID 159489180
2-[6-(4-cyanophenyl)indol-1-yl]-N-[2-[cyclohexyl(methyl)amino]ethyl]acetamide;N-[2-[cyclohexyl(ethyl)amino]ethyl]-2-[6-(4-methylphenyl)indol-1-yl]acetamide;methyl 1-[2-[2-[cyclohexyl(methyl)amino]ethylamino]-2-oxoethyl]-6-(4-methylphenyl)indole-2-carboxylate;2-[6-(4-methylphenyl)indol-1-yl]-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide
CID 159560251
2-aminoethanol;chloromethylidene(dimethyl)azanium;1,3-dihydroindol-2-one;ethyl 5-formyl-4-methyl-1H-pyrrole-2-carboxylate;ethyl 4-methyl-5-[(Z)-(2-oxo-1H-indol-3-ylidene)methyl]-1H-pyrrole-2-carboxylate;ethyl 4-methyl-1H-pyrrole-2-carboxylate;N-(2-hydroxyethyl)-4-methyl-5-[(Z)-(2-oxo-1H-indol-3-ylidene)methyl]-1H-pyrrole-2-carboxamide;(3Z)-3-[[5-(hydroxymethyl)-3-methyl-1H-pyrrol-2-yl]methylidene]-1H-indol-2-one;4-methyl-5-[(Z)-(2-oxo-1H-indol-3-ylidene)methyl]-1H-pyrrole-2-carboxylic acid;(3Z)-3-[[3-methyl-5-(pyridin-1-ium-1-ylmethyl)-1H-pyrrol-2-yl]methylidene]-1H-indol-2-one;dichloride
CID 159777929
diethyl 1H-indole-2,6-dicarboxylate;ethyl 4-bromobutanoate;9-oxo-7,8-dihydro-6H-pyrido[1,2-a]indole-3-carboxylic acid;9-oxo-N-pyridin-3-yl-7,8-dihydro-6H-pyrido[1,2-a]indole-3-carboxamide;pyridin-3-amine
CID 161326341
tert-butyl 6-[hydroxy-[3-(4-methylpiperazin-1-yl)phenyl]methyl]-1-methyl-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxylate;tert-butyl 6-[hydroxy-[3-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methyl-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxylate;tert-butyl 1-methyl-6-[3-(4-methylpiperazin-1-yl)benzoyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxylate;tert-butyl 3-methyl-6-[3-(4-methylpiperazin-1-yl)benzoyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxylate;(1-methyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-6-yl)-[3-(4-methylpiperazin-1-yl)phenyl]methanol;(3-methyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-6-yl)-[3-(4-methylpiperazin-1-yl)phenyl]methanol;dihydrochloride
CID 163837244

Frequently Asked Questions

What is the IUPAC name of sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide?
The IUPAC name of sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide (CID 159300106) is sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide.
What is the SMILES notation for sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide?
The canonical SMILES for sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide is CC1(C)CNC(=O)c2cc3ccc(C(=O)Nc4cccnc4)cc3n21.CC1(C)CNC(=O)c2cc3ccc(C(=O)O)cc3n21.CCOC(=O)c1ccc2cc(C(=O)OCC)n(C(C)(C)C#N)c2c1.CCOC(=O)c1ccc2cc(C(=O)OCC)n(CC#N)c2c1.CCOC(=O)c1ccc2cc3n(c2c1)C(C)(C)CNC3=O.Nc1cccnc1.O=C(Cl)C(=O)Cl.[Na+].[OH-].
What is the InChIKey of sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide?
The InChIKey is LBFLRVVSQKMOCS-UHFFFAOYSA-M. The full InChI is InChI=1S/C19H18N4O2.C18H20N2O4.C16H16N2O4.C16H18N2O3.C14H14N2O3.C5H6N2.C2Cl2O2.Na.H2O/c1-19(2)11-21-18(25)16-8-12-5-6-13(9-15(12)23(16)19)17(24)22-14-4-3-7-20-10-14;1-5-23-16(21)13-8-7-12-9-15(17(22)24-6-2)20(14(12)10-13)18(3,4)11-19;1-3-21-15(19)12-6-5-11-9-14(16(20)22-4-2)18(8-7-17)13(11)10-12;1-4-21-15(20)11-6-5-10-7-13-14(19)17-9-16(2,3)18(13)12(10)8-11;1-14(2)7-15-12(17)11-5-8-3-4-9(13(18)19)6-10(8)16(11)14;6-5-2-1-3-7-4-5;3-1(5)2(4)6;;/h3-10H,11H2,1-2H3,(H,21,25)(H,22,24);7-10H,5-6H2,1-4H3;5-6,9-10H,3-4,8H2,1-2H3;5-8H,4,9H2,1-3H3,(H,17,19);3-6H,7H2,1-2H3,(H,15,17)(H,18,19);1-4H,6H2;;;1H2/q;;;;;;;+1;/p-1.
What are the key properties of sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide?
sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide has a molecular weight of 1768.71 g/mol, XLogP of 10.66, 16 rotatable bonds, 6 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;diethyl 1-(cyanomethyl)indole-2,6-dicarboxylate;diethyl 1-(2-cyanopropan-2-yl)indole-2,6-dicarboxylate;4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylic acid;4,4-dimethyl-1-oxo-N-pyridin-3-yl-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide;ethyl 4,4-dimethyl-1-oxo-2,3-dihydropyrazino[1,2-a]indole-7-carboxylate;oxalyl dichloride;pyridin-3-amine;hydroxide is sourced from PubChem (CID 159300106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).