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Compound 36
  CheckMol                        TMF02:r0:m0
MF=C16H12ClFN2O MW=302.74
 21 23  0  4  0               999 V2000
    0.0000   -0.0000   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.2869    0.7556   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2751    2.2668   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5738    0.0118   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5620    3.0224   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8607    0.7674   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.3258    4.5218   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8489    2.2786   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.3294    5.6316   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8855    4.9705   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.2302    2.8335   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8170    5.5372   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5431    6.4462   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.2243    3.9669   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.6552    4.2739   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3164    1.8300   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6293    7.4734   -0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8973    6.8949   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.6647    4.4156   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    7.1310    4.5100   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0071    5.8913   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3 02  0  1  0  0
  2  4 01  0  1  0  0
  3  5 01  0  1  0  0
  4  6 02  0  1  0  0
  5  7  1  0  1  0  0
  5  8 02  0  2  0  0
  7  9  2  0  1  0  0
  7 10  1  0  0  0  0
  8 11  1  0  1  0  0
  9 12  1  0  1  0  0
 10 13 02  0  1  0  0
 10 14 01  0  1  0  0
 11 15  1  0  1  0  0
 11 16  1  0  0  0  0
 13 17  1  0  0  0  0
 13 18 01  0  1  0  0
 14 19 02  0  1  0  0
 15 20  2  0  0  0  0
 18 21 02  0  1  0  0
  6  8 01  0  1  0  0
 12 15  1  0  1  0  0
 19 21 01  0  1  0  0
M  END

Fludiazepam

₹ 0.00 0.00

Chemical Name - Fludiazepam
Mol Weight - 302.735
Smiles - CN(c(ccc(Cl)c1)c1C(c(cccc1)c1F)=NC1)C1=O

Property Name	Property Value
Mol Name	Fludiazepam
Molweight	302.735
Monoisotopic Mass	302.062218
Clogp	3.0854
Clogs	-4.986
H Acceptors	3
Total Surface Area	218.33
Relative Psa	0.1287
Polar Surface Area	32.67
Druglikeness	2.5438
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Shape Index	0.42857
Molecular Flexibility	0.28182
Molecular Complexity	0.85413
Fragments	1
Non H Atoms	21
Non Ch Atoms	5
Electronegative Atoms	5
Rotatable Bonds	1
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3 Atoms	2
Amides	1
Smiles	CN(c(ccc(Cl)c1)c1C(c(cccc1)c1F)=NC1)C1=O
InChIKey
InChI	C16H12N2OClF

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Fludiazepam