5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid

C83H104F4N16O47P8 — CID 172963900

IUPAC5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid
SMILESCO/N=C1/CN(c2nc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)CC1CNC(=O)OC(P(=O)(O)O)P(=O)(O)O.COc1c(N2CCN(C(=O)OC(P(=O)(O)O)P(=O)(O)O)C(C)C2)c(F)c(N)c2c(=O)c(C(=O)O)cn(C3CC3)c12.COc1c(N2CCNC(C)C2)c(F)c(NC(=O)OC(P(=O)(O)O)P(=O)(O)O)c2c(=O)c(C(=O)O)cn(C3CC3)c12.Cc1c(F)c(N2CCN(C(=O)OC(P(=O)(O)O)P(=O)(O)O)C(C)C2)cc2c1c(=O)c(C(=O)O)cn2C1CC1
InChIInChI=1S/2C21H27FN4O12P2.C21H26FN3O11P2.C20H24FN5O12P2/c1-9-7-24(5-6-25(9)20(30)38-21(39(31,32)33)40(34,35)36)16-13(22)14(23)12-15(18(16)37-2)26(10-3-4-10)8-11(17(12)27)19(28)29;1-9-7-25(6-5-23-9)16-13(22)14(24-20(30)38-21(39(31,32)33)40(34,35)36)12-15(18(16)37-2)26(10-3-4-10)8-11(17(12)27)19(28)29;1-10-8-23(5-6-24(10)20(29)36-21(37(30,31)32)38(33,34)35)15-7-14-16(11(2)17(15)22)18(26)13(19(27)28)9-25(14)12-3-4-12;1-37-24-14-8-25(6-9(14)5-22-19(30)38-20(39(31,32)33)40(34,35)36)17-13(21)4-11-15(27)12(18(28)29)7-26(10-2-3-10)16(11)23-17/h8-10,21H,3-7,23H2,1-2H3,(H,28,29)(H2,31,32,33)(H2,34,35,36);8-10,21,23H,3-7H2,1-2H3,(H,24,30)(H,28,29)(H2,31,32,33)(H2,34,35,36);7,9-10,12,21H,3-6,8H2,1-2H3,(H,27,28)(H2,30,31,32)(H2,33,34,35);4,7,9-10,20H,2-3,5-6,8H2,1H3,(H,22,30)(H,28,29)(H2,31,32,33)(H2,34,35,36)/b;;;24-14-
InChIKeyWTBRMYXDBAJXRB-IWDYUPRVSA-N
MW2401.59 g/mol
LogP4.36
Rot. Bonds30

About 5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid

5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid (PubChem CID 172963900) has the molecular formula C83H104F4N16O47P8 and a molecular weight of 2401.59 g/mol. Its IUPAC name is 5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid.

Molecular Properties

Compound Name5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid
PubChem CID172963900
Molecular FormulaC83H104F4N16O47P8
Molecular Weight2401.59 g/mol
Exact Mass2400.41
IUPAC Name5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid
SMILESCO/N=C1/CN(c2nc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)CC1CNC(=O)OC(P(=O)(O)O)P(=O)(O)O.COc1c(N2CCN(C(=O)OC(P(=O)(O)O)P(=O)(O)O)C(C)C2)c(F)c(N)c2c(=O)c(C(=O)O)cn(C3CC3)c12.COc1c(N2CCNC(C)C2)c(F)c(NC(=O)OC(P(=O)(O)O)P(=O)(O)O)c2c(=O)c(C(=O)O)cn(C3CC3)c12.Cc1c(F)c(N2CCN(C(=O)OC(P(=O)(O)O)P(=O)(O)O)C(C)C2)cc2c1c(=O)c(C(=O)O)cn2C1CC1
InChIInChI=1S/2C21H27FN4O12P2.C21H26FN3O11P2.C20H24FN5O12P2/c1-9-7-24(5-6-25(9)20(30)38-21(39(31,32)33)40(34,35)36)16-13(22)14(23)12-15(18(16)37-2)26(10-3-4-10)8-11(17(12)27)19(28)29;1-9-7-25(6-5-23-9)16-13(22)14(24-20(30)38-21(39(31,32)33)40(34,35)36)12-15(18(16)37-2)26(10-3-4-10)8-11(17(12)27)19(28)29;1-10-8-23(5-6-24(10)20(29)36-21(37(30,31)32)38(33,34)35)15-7-14-16(11(2)17(15)22)18(26)13(19(27)28)9-25(14)12-3-4-12;1-37-24-14-8-25(6-9(14)5-22-19(30)38-20(39(31,32)33)40(34,35)36)17-13(21)4-11-15(27)12(18(28)29)7-26(10-2-3-10)16(11)23-17/h8-10,21H,3-7,23H2,1-2H3,(H,28,29)(H2,31,32,33)(H2,34,35,36);8-10,21,23H,3-7H2,1-2H3,(H,24,30)(H,28,29)(H2,31,32,33)(H2,34,35,36);7,9-10,12,21H,3-6,8H2,1-2H3,(H,27,28)(H2,30,31,32)(H2,33,34,35);4,7,9-10,20H,2-3,5-6,8H2,1H3,(H,22,30)(H,28,29)(H2,31,32,33)(H2,34,35,36)/b;;;24-14-
InChIKeyWTBRMYXDBAJXRB-IWDYUPRVSA-N
XLogP4.36
TPSA937.13 Ų
H-Bond Donors24
H-Bond Acceptors39
Rotatable Bonds30
Heavy Atoms158
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002401.59
LogP ≤ 54.36
H-Bond Donors ≤ 524
H-Bond Acceptors ≤ 1039

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze 5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid with MolForge

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Launch Full Analysis

Related Compounds

1-cyclopropyl-7-[(4E)-3-[(cyclopropylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
CID 127035784
5-amino-1-cyclopropyl-7-[4-[4-(2,2-diphosphonoethyl)phenoxy]carbonyl-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid
CID 138699119
[2-[bis(diethoxyphosphoryl)methylamino]-2-oxoethyl] 1-cyclopropyl-6-fluoro-8-methoxy-7-[3-methyl-4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylate;1-cyclopropyl-6-fluoro-8-methoxy-7-[3-methyl-4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid;[[[2-[1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carbonyl]oxyacetyl]amino]-phosphonomethyl]phosphonic acid
CID 160989562
1-cyclopropyl-6-fluoro-5-methyl-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;hydrate;hydrochloride
CID 139032857
1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;hydrobromide
CID 140541872
1-cyclopropyl-6-fluoro-7-[4-[hydroxy(methoxy)phosphoryl]-3-methylpiperazin-1-yl]-5-methyl-4-oxoquinoline-3-carboxylic acid;ethane
CID 143187150
5-amino-1-cyclopropyl-6-fluoro-8-methyl-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid
CID 10571433
1-cyclopropyl-7-(4-dimethoxyphosphoryl-3-methylpiperazin-1-yl)-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid
CID 58600511
7-[(4Z)-3-(aminomethyl)-4-ethoxyiminopyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
CID 11795435
7-[(4Z)-3-(aminomethyl)-4-[(3,4,5-trimethoxyphenyl)methoxyimino]pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
CID 70694830
7-[3-(aminomethyl)-4-[(2-methylpropan-2-yl)oxyimino]pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
CID 54353867
S-[2-(methylamino)-2-oxoethyl] 1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carbothioate
CID 89381313

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid?
The IUPAC name of 5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid (CID 172963900) is 5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid.
What is the SMILES notation for 5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid?
The canonical SMILES for 5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid is CO/N=C1/CN(c2nc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)CC1CNC(=O)OC(P(=O)(O)O)P(=O)(O)O.COc1c(N2CCN(C(=O)OC(P(=O)(O)O)P(=O)(O)O)C(C)C2)c(F)c(N)c2c(=O)c(C(=O)O)cn(C3CC3)c12.COc1c(N2CCNC(C)C2)c(F)c(NC(=O)OC(P(=O)(O)O)P(=O)(O)O)c2c(=O)c(C(=O)O)cn(C3CC3)c12.Cc1c(F)c(N2CCN(C(=O)OC(P(=O)(O)O)P(=O)(O)O)C(C)C2)cc2c1c(=O)c(C(=O)O)cn2C1CC1.
What is the InChIKey of 5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid?
The InChIKey is WTBRMYXDBAJXRB-IWDYUPRVSA-N. The full InChI is InChI=1S/2C21H27FN4O12P2.C21H26FN3O11P2.C20H24FN5O12P2/c1-9-7-24(5-6-25(9)20(30)38-21(39(31,32)33)40(34,35)36)16-13(22)14(23)12-15(18(16)37-2)26(10-3-4-10)8-11(17(12)27)19(28)29;1-9-7-25(6-5-23-9)16-13(22)14(24-20(30)38-21(39(31,32)33)40(34,35)36)12-15(18(16)37-2)26(10-3-4-10)8-11(17(12)27)19(28)29;1-10-8-23(5-6-24(10)20(29)36-21(37(30,31)32)38(33,34)35)15-7-14-16(11(2)17(15)22)18(26)13(19(27)28)9-25(14)12-3-4-12;1-37-24-14-8-25(6-9(14)5-22-19(30)38-20(39(31,32)33)40(34,35)36)17-13(21)4-11-15(27)12(18(28)29)7-26(10-2-3-10)16(11)23-17/h8-10,21H,3-7,23H2,1-2H3,(H,28,29)(H2,31,32,33)(H2,34,35,36);8-10,21,23H,3-7H2,1-2H3,(H,24,30)(H,28,29)(H2,31,32,33)(H2,34,35,36);7,9-10,12,21H,3-6,8H2,1-2H3,(H,27,28)(H2,30,31,32)(H2,33,34,35);4,7,9-10,20H,2-3,5-6,8H2,1H3,(H,22,30)(H,28,29)(H2,31,32,33)(H2,34,35,36)/b;;;24-14-.
What are the key properties of 5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid?
5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid has a molecular weight of 2401.59 g/mol, XLogP of 4.36, 30 rotatable bonds, 24 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-5-(diphosphonomethoxycarbonylamino)-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid;1-cyclopropyl-7-[(4E)-3-[(diphosphonomethoxycarbonylamino)methyl]-4-methoxyiminopyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;1-cyclopropyl-7-[4-(diphosphonomethoxycarbonyl)-3-methylpiperazin-1-yl]-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid is sourced from PubChem (CID 172963900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).