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Table 1 Chemo-informatics characteristic of the newly synthesized compounds 2a–2f

From: Synthesis of novel isoxazole–carboxamide derivatives as promising agents for melanoma and targeted nano-emulgel conjugate for improved cellular permeability

Properties

2a

2b

2c

2d

2e

2f

Standard

M.Wt. (g/mol)

372.09

346.09

400.14

324.09

362.09

360.09

 < 500

HBA

5

3

5

4

4

4

 < 10

HBD

1

1

1

1

1

1

 < 5

Log P

3.70

4.22

4.74

3.78

4.41

4.53

 < 5

PSA (A2)

59.85

45.29

59.75

45.29

51.23

46.04

 < 89

nrotb

5

4

6

4

5

4

 < 10

Drug Score

0.31

− 0.04

0.50

0.38

0.45

0.61

0.0–2.0

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BMC Chemistry

ISSN: 2661-801X

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