3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one

C135H153Cl4FN18O11 — CID 158856904

IUPAC3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one
SMILESCC(CC(=O)N1C2CC3CC1CC(C#N)(C3)C2)c1c[nH]c2ncc(Cl)cc12.CC(CC(=O)N1C2CC3CC1CC(C#N)(C3)C2)c1c[nH]c2nccc(C3CC3)c12.CC(CC(=O)N1C2CC3CC1CC(O)(C3)C2)c1c[nH]c2cc(Cl)c(F)cc12.CC(CC(=O)N1C2CC3CC1CC(O)(C3)C2)c1c[nH]c2ncc(Cl)cc12.O=C(CC(c1ccccc1)c1c[nH]c2cc(Cl)ccc12)N1C2CC3CC1CC(C(=O)O)(C3)C2.O=C(CCc1c[nH]c2nccc(C3CC3)c12)N1C2CC3CC1CC(O)(C3)C2
InChIInChI=1S/C27H27ClN2O3.C24H28N4O.C22H27N3O2.C21H24ClFN2O2.C21H23ClN4O.C20H24ClN3O2/c28-18-6-7-21-23(15-29-24(21)10-18)22(17-4-2-1-3-5-17)11-25(31)30-19-8-16-9-20(30)14-27(12-16,13-19)26(32)33;1-14(20-12-27-23-22(20)19(4-5-26-23)16-2-3-16)6-21(29)28-17-7-15-8-18(28)11-24(9-15,10-17)13-25;26-19(25-16-7-13-8-17(25)11-22(27,9-13)10-16)4-3-15-12-24-21-20(15)18(5-6-23-21)14-1-2-14;1-11(16-10-24-19-6-17(22)18(23)5-15(16)19)2-20(26)25-13-3-12-4-14(25)9-21(27,7-12)8-13;1-12(18-10-25-20-17(18)5-14(22)9-24-20)2-19(27)26-15-3-13-4-16(26)8-21(6-13,7-15)11-23;1-11(17-10-23-19-16(17)5-13(21)9-22-19)2-18(25)24-14-3-12-4-15(24)8-20(26,6-12)7-14/h1-7,10,15-16,19-20,22,29H,8-9,11-14H2,(H,32,33);4-5,12,14-18H,2-3,6-11H2,1H3,(H,26,27);5-6,12-14,16-17,27H,1-4,7-11H2,(H,23,24);5-6,10-14,24,27H,2-4,7-9H2,1H3;5,9-10,12-13,15-16H,2-4,6-8H2,1H3,(H,24,25);5,9-12,14-15,26H,2-4,6-8H2,1H3,(H,22,23)
InChIKeyJAEBXJWNSTZJKB-UHFFFAOYSA-N
MW2364.63 g/mol
LogP25.85
Rot. Bonds22

About 3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one

3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one (PubChem CID 158856904) has the molecular formula C135H153Cl4FN18O11 and a molecular weight of 2364.63 g/mol. Its IUPAC name is 3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one.

Molecular Properties

Compound Name3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one
PubChem CID158856904
Molecular FormulaC135H153Cl4FN18O11
Molecular Weight2364.63 g/mol
Exact Mass2361.07
IUPAC Name3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one
SMILESCC(CC(=O)N1C2CC3CC1CC(C#N)(C3)C2)c1c[nH]c2ncc(Cl)cc12.CC(CC(=O)N1C2CC3CC1CC(C#N)(C3)C2)c1c[nH]c2nccc(C3CC3)c12.CC(CC(=O)N1C2CC3CC1CC(O)(C3)C2)c1c[nH]c2cc(Cl)c(F)cc12.CC(CC(=O)N1C2CC3CC1CC(O)(C3)C2)c1c[nH]c2ncc(Cl)cc12.O=C(CC(c1ccccc1)c1c[nH]c2cc(Cl)ccc12)N1C2CC3CC1CC(C(=O)O)(C3)C2.O=C(CCc1c[nH]c2nccc(C3CC3)c12)N1C2CC3CC1CC(O)(C3)C2
InChIInChI=1S/C27H27ClN2O3.C24H28N4O.C22H27N3O2.C21H24ClFN2O2.C21H23ClN4O.C20H24ClN3O2/c28-18-6-7-21-23(15-29-24(21)10-18)22(17-4-2-1-3-5-17)11-25(31)30-19-8-16-9-20(30)14-27(12-16,13-19)26(32)33;1-14(20-12-27-23-22(20)19(4-5-26-23)16-2-3-16)6-21(29)28-17-7-15-8-18(28)11-24(9-15,10-17)13-25;26-19(25-16-7-13-8-17(25)11-22(27,9-13)10-16)4-3-15-12-24-21-20(15)18(5-6-23-21)14-1-2-14;1-11(16-10-24-19-6-17(22)18(23)5-15(16)19)2-20(26)25-13-3-12-4-14(25)9-21(27,7-12)8-13;1-12(18-10-25-20-17(18)5-14(22)9-24-20)2-19(27)26-15-3-13-4-16(26)8-21(6-13,7-15)11-23;1-11(17-10-23-19-16(17)5-13(21)9-22-19)2-18(25)24-14-3-12-4-15(24)8-20(26,6-12)7-14/h1-7,10,15-16,19-20,22,29H,8-9,11-14H2,(H,32,33);4-5,12,14-18H,2-3,6-11H2,1H3,(H,26,27);5-6,12-14,16-17,27H,1-4,7-11H2,(H,23,24);5-6,10-14,24,27H,2-4,7-9H2,1H3;5,9-10,12-13,15-16H,2-4,6-8H2,1H3,(H,24,25);5,9-12,14-15,26H,2-4,6-8H2,1H3,(H,22,23)
InChIKeyJAEBXJWNSTZJKB-UHFFFAOYSA-N
XLogP25.85
TPSA413.73 Ų
H-Bond Donors10
H-Bond Acceptors16
Rotatable Bonds22
Heavy Atoms169
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002364.63
LogP ≤ 525.85
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1016

Analyze 3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one?
The IUPAC name of 3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one (CID 158856904) is 3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one.
What is the SMILES notation for 3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one?
The canonical SMILES for 3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one is CC(CC(=O)N1C2CC3CC1CC(C#N)(C3)C2)c1c[nH]c2ncc(Cl)cc12.CC(CC(=O)N1C2CC3CC1CC(C#N)(C3)C2)c1c[nH]c2nccc(C3CC3)c12.CC(CC(=O)N1C2CC3CC1CC(O)(C3)C2)c1c[nH]c2cc(Cl)c(F)cc12.CC(CC(=O)N1C2CC3CC1CC(O)(C3)C2)c1c[nH]c2ncc(Cl)cc12.O=C(CC(c1ccccc1)c1c[nH]c2cc(Cl)ccc12)N1C2CC3CC1CC(C(=O)O)(C3)C2.O=C(CCc1c[nH]c2nccc(C3CC3)c12)N1C2CC3CC1CC(O)(C3)C2.
What is the InChIKey of 3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one?
The InChIKey is JAEBXJWNSTZJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H27ClN2O3.C24H28N4O.C22H27N3O2.C21H24ClFN2O2.C21H23ClN4O.C20H24ClN3O2/c28-18-6-7-21-23(15-29-24(21)10-18)22(17-4-2-1-3-5-17)11-25(31)30-19-8-16-9-20(30)14-27(12-16,13-19)26(32)33;1-14(20-12-27-23-22(20)19(4-5-26-23)16-2-3-16)6-21(29)28-17-7-15-8-18(28)11-24(9-15,10-17)13-25;26-19(25-16-7-13-8-17(25)11-22(27,9-13)10-16)4-3-15-12-24-21-20(15)18(5-6-23-21)14-1-2-14;1-11(16-10-24-19-6-17(22)18(23)5-15(16)19)2-20(26)25-13-3-12-4-14(25)9-21(27,7-12)8-13;1-12(18-10-25-20-17(18)5-14(22)9-24-20)2-19(27)26-15-3-13-4-16(26)8-21(6-13,7-15)11-23;1-11(17-10-23-19-16(17)5-13(21)9-22-19)2-18(25)24-14-3-12-4-15(24)8-20(26,6-12)7-14/h1-7,10,15-16,19-20,22,29H,8-9,11-14H2,(H,32,33);4-5,12,14-18H,2-3,6-11H2,1H3,(H,26,27);5-6,12-14,16-17,27H,1-4,7-11H2,(H,23,24);5-6,10-14,24,27H,2-4,7-9H2,1H3;5,9-10,12-13,15-16H,2-4,6-8H2,1H3,(H,24,25);5,9-12,14-15,26H,2-4,6-8H2,1H3,(H,22,23).
What are the key properties of 3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one?
3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one has a molecular weight of 2364.63 g/mol, XLogP of 25.85, 22 rotatable bonds, 10 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-chloro-5-fluoro-1H-indol-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(6-chloro-1H-indol-3-yl)-3-phenylpropanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carboxylic acid;2-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)butan-1-one;2-[3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butanoyl]-2-azatricyclo[3.3.1.13,7]decane-5-carbonitrile;3-(4-cyclopropyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1-(5-hydroxy-2-azatricyclo[3.3.1.13,7]decan-2-yl)propan-1-one is sourced from PubChem (CID 158856904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).