acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one

C137H143F10N25O19 — CID 161264398

About acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one

acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one (PubChem CID 161264398) has the molecular formula C137H143F10N25O19 and a molecular weight of 2633.79 g/mol. Its IUPAC name is acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one.

Molecular Properties

• Compound Name: acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one
• PubChem CID: 161264398
• Molecular Formula: C137H143F10N25O19
• Molecular Weight: 2633.79 g/mol
• Exact Mass: 2632.08
• IUPAC Name: acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one
• SMILES: CC(=O)O.CC(=O)c1cn2c3c(c(NCCCc4cccc5ccccc45)c(F)c(N)c3c1=O)OCC2C.CC(=O)c1cn2c3c(c(NCCCn4cnc5ccccc54)c(F)c(N)c3c1=O)OCC2.CC(C)=O.Cc1cn2c3c(c(NCCCc4cccc(C(F)(F)F)n4)c(F)c(N)c3c1=O)OCC2C.Cc1cn2c3c(c(NCCCc4cccc(F)n4)c(F)c(N)c3c1=O)OCC2C.Cc1cn2c3c(c(NCCCc4ccccn4)c(F)c(N)c3c1=O)OCCC2.Nc1c(F)c(NCCCn2ccnc2)c2c3c1c(=O)c(C(=O)O)cn3CCO2
• InChI: InChI=1S/C27H26FN3O3.C23H22FN5O3.C22H22F4N4O2.C21H22F2N4O2.C21H23FN4O2.C18H18FN5O4.C3H6O.C2H4O2/c1-15-14-34-27-24(30-12-6-10-18-9-5-8-17-7-3-4-11-19(17)18)22(28)23(29)21-25(27)31(15)13-20(16(2)32)26(21)33;1-13(30)14-11-28-9-10-32-23-20(18(24)19(25)17(21(23)28)22(14)31)26-7-4-8-29-12-27-15-5-2-3-6-16(15)29;1-11-9-30-12(2)10-32-21-18(16(23)17(27)15(19(21)30)20(11)31)28-8-4-6-13-5-3-7-14(29-13)22(24,25)26;1-11-9-27-12(2)10-29-21-18(16(23)17(24)15(19(21)27)20(11)28)25-8-4-6-13-5-3-7-14(22)26-13;1-13-12-26-10-5-11-28-21-18(16(22)17(23)15(19(21)26)20(13)27)25-9-4-7-14-6-2-3-8-24-14;19-12-13(20)11-15-17(14(12)22-2-1-4-23-5-3-21-9-23)28-7-6-24(15)8-10(16(11)25)18(26)27;1-3(2)4;1-2(3)4/h3-5,7-9,11,13,15,30H,6,10,12,14,29H2,1-2H3;2-3,5-6,11-12,26H,4,7-10,25H2,1H3;3,5,7,9,12,28H,4,6,8,10,27H2,1-2H3;3,5,7,9,12,25H,4,6,8,10,24H2,1-2H3;2-3,6,8,12,25H,4-5,7,9-11,23H2,1H3;3,5,8-9,22H,1-2,4,6-7,20H2,(H,26,27);1-2H3;1H3,(H,3,4)
• InChIKey: ICZQDKQBRWHINW-UHFFFAOYSA-N
• XLogP: 21.70
• TPSA: 615.80 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 42
• Rotatable Bonds: 33
• Heavy Atoms: 191
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2633.79
LogP ≤ 5	21.70
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	42

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one?

The IUPAC name of acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one (CID 161264398) is acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one.

What is the SMILES notation for acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one?

The canonical SMILES for acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one is CC(=O)O.CC(=O)c1cn2c3c(c(NCCCc4cccc5ccccc45)c(F)c(N)c3c1=O)OCC2C.CC(=O)c1cn2c3c(c(NCCCn4cnc5ccccc54)c(F)c(N)c3c1=O)OCC2.CC(C)=O.Cc1cn2c3c(c(NCCCc4cccc(C(F)(F)F)n4)c(F)c(N)c3c1=O)OCC2C.Cc1cn2c3c(c(NCCCc4cccc(F)n4)c(F)c(N)c3c1=O)OCC2C.Cc1cn2c3c(c(NCCCc4ccccn4)c(F)c(N)c3c1=O)OCCC2.Nc1c(F)c(NCCCn2ccnc2)c2c3c1c(=O)c(C(=O)O)cn3CCO2.

What is the InChIKey of acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one?

The InChIKey is ICZQDKQBRWHINW-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26FN3O3.C23H22FN5O3.C22H22F4N4O2.C21H22F2N4O2.C21H23FN4O2.C18H18FN5O4.C3H6O.C2H4O2/c1-15-14-34-27-24(30-12-6-10-18-9-5-8-17-7-3-4-11-19(17)18)22(28)23(29)21-25(27)31(15)13-20(16(2)32)26(21)33;1-13(30)14-11-28-9-10-32-23-20(18(24)19(25)17(21(23)28)22(14)31)26-7-4-8-29-12-27-15-5-2-3-6-16(15)29;1-11-9-30-12(2)10-32-21-18(16(23)17(27)15(19(21)30)20(11)31)28-8-4-6-13-5-3-7-14(29-13)22(24,25)26;1-11-9-27-12(2)10-29-21-18(16(23)17(24)15(19(21)27)20(11)28)25-8-4-6-13-5-3-7-14(22)26-13;1-13-12-26-10-5-11-28-21-18(16(22)17(23)15(19(21)26)20(13)27)25-9-4-7-14-6-2-3-8-24-14;19-12-13(20)11-15-17(14(12)22-2-1-4-23-5-3-21-9-23)28-7-6-24(15)8-10(16(11)25)18(26)27;1-3(2)4;1-2(3)4/h3-5,7-9,11,13,15,30H,6,10,12,14,29H2,1-2H3;2-3,5-6,11-12,26H,4,7-10,25H2,1H3;3,5,7,9,12,28H,4,6,8,10,27H2,1-2H3;3,5,7,9,12,25H,4,6,8,10,24H2,1-2H3;2-3,6,8,12,25H,4-5,7,9-11,23H2,1H3;3,5,8-9,22H,1-2,4,6-7,20H2,(H,26,27);1-2H3;1H3,(H,3,4).

What are the key properties of acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one?

acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one has a molecular weight of 2633.79 g/mol, XLogP of 21.70, 33 rotatable bonds, 14 hydrogen bond donors, and 42 hydrogen bond acceptors.

Where does this data come from?

All data for acetic acid;11-acetyl-8-amino-6-[3-(benzimidazol-1-yl)propylamino]-7-fluoro-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;11-acetyl-8-amino-7-fluoro-2-methyl-6-(3-naphthalen-1-ylpropylamino)-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-2,11-dimethyl-6-[3-[6-(trifluoromethyl)-2-pyridinyl]propylamino]-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-[3-(6-fluoro-2-pyridinyl)propylamino]-2,11-dimethyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraen-10-one;8-amino-7-fluoro-6-(3-imidazol-1-ylpropylamino)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid;6-amino-7-fluoro-3-methyl-8-(3-pyridin-2-ylpropylamino)-10-oxa-1-azatricyclo[7.4.1.05,14]tetradeca-2,5,7,9(14)-tetraen-4-one;propan-2-one is sourced from PubChem (CID 161264398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).