Compound no.

Logp

TPSA A²

(% ABS)

MW

HBA

HBD

N vio

Nrotb

Volume A³

≤5

-

-

˂500

˂10

˂5

≤1

-

-

1

2.319

90.4330

77.80062

398.410

6

2

0

6

324.075

2

2.121

73.3620

83.69011

370.400

5

2

0

5

305.091

3

2.378

102.460

73.65130

413.425

7

3

0

6

336.477

4

1.862

119.531

67.76181

449.480

8

3

0

7

348.925

5

0.400

101.709

73.91040

435.449

7

1

0

6

333.252

6

2.102

107.504

71.91112

434.465

7

2

0

6

336.523

7

0.671

101.709

73.91040

449.476

7

1

0

7

350.054

8

1.832

107.504

71.91112

420.438

7

2

0

5

319.721

9

2.477

93.5080

76.73974

448.492

7

1

0

7

354.197

10

2.722

84.7190

79.77195

462.519

7

0

0

7

371.140

11

1.279

107.504

71.91112

366.468

7

2

0

5

305.225

12

1.656

107.504

71.91112

380.495

7

2

0

5

321.786

13

1.264

116.738

68.72539

396.494

8

2

0

6

330.771

14

1.885

107.504

71.91112

400.913

7

2

0

5

318.761

15

2.479

107.504

71.91112

448.492

7

2

0

6

353.083

16

2.479

107.504

71.91112

448.492

7

2

0

6

353.083

HOF

2.076

95.1500

76.17325

292.213

6

2

0

4

227.700