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Compound 10
  CheckMol                        TMF02:r0:m0
MF=C17H19FN4O4 MW=362.36
 26 29  0  8  0               999 V2000
    0.0000   -0.0000   -0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3120   -0.7328   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3238   -2.2221   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6240    0.0236   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0355   -2.9667   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6358   -2.9549   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9360   -0.7210   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2529   -2.2103   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0473   -4.4560   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6476   -4.4442   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9478   -2.1985   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2480    0.0355   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5412   -2.9549   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2411   -5.2007   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9596   -5.1889   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2598   -2.9431   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2598    1.5484   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5599   -0.7092   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5294   -4.4442   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2716   -4.4324   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5718   -2.1866   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -7.8719    0.0473   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8178   -5.1889   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5836   -5.1652   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1839   -0.6855   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8837    1.5602   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3 02  0  2  0  0
  2  4 01  0  2  0  0
  3  5  1  0  0  0  0
  3  6 01  0  2  0  0
  4  7 02  0  2  0  0
  5  8  1  0  1  0  0
  5  9  1  0  1  0  0
  6 10  1  0  2  0  0
  6 11 02  0  2  0  0
  7 12 01  0  2  0  0
  8 13  1  0  1  0  0
  9 14  1  0  1  0  0
 10 15  1  0  2  0  0
 11 16 01  0  2  0  0
 12 17  2  0  0  0  0
 12 18 01  0  2  0  0
 13 19  1  0  1  0  0
 15 20  1  0  2  0  0
 16 21 01  0  2  0  0
 18 22  1  0  0  0  0
 19 23  1  0  0  0  0
 20 24  1  0  0  0  0
 22 25  2  0  0  0  0
 22 26  1  0  0  0  0
  7 11 01  0  2  0  0
 14 19  1  0  1  0  0
 16 20  1  0  2  0  0
 18 21 02  0  2  0  0
M  END

Marbofloxacin

₹ 0.00 0.00

Chemical Name - Marbofloxacin
Mol Weight - 362.36
Smiles - CN(CC1)CCN1c(c1c(c(C(C(C(O)=O)=C2)=O)c3)N2N(C)CO1)c3F

Property Name	Property Value
Mol Name	Marbofloxacin
Molweight	362.36
Monoisotopic Mass	362.139034
Clogp	-1.5968
Clogs	-1.846
H Acceptors	8
H Donors	1
Total Surface Area	250.19
Relative Psa	0.25333
Polar Surface Area	76.56
Druglikeness	5.7
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.5
Molecular Flexibility	0.31465
Molecular Complexity	0.97444
Fragments	1
Non H Atoms	26
Non Ch Atoms	9
Electronegative Atoms	9
Rotatable Bonds	2
Rings Closures	4
Small Rings	4
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	12
Symmetric Atoms	2
Amines	2
Alkyl Amines	1
Aromatic Amines	1
Basic Nitrogens	1
Acidic Oxygens	1
Smiles	CN(CC1)CCN1c(c1c(c(C(C(C(O)=O)=C2)=O)c3)N2N(C)CO1)c3F
InChIKey	InChI=1S/C17H19FN4O4/c1-19-3-5-21(6-4-19)14-12(18)7-10-13-16(14)26-9-20(2)22(13)8-11(15(10)23)17(24)25/h7-8H,3-6,9H2,1-2H3,(H,24,25)
InChI	BPFYOAJNDMUVBL-UHFFFAOYSA-N

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Marbofloxacin