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Table 6 Lead molecules obtained from pharmacophore screening

From: In silico screening for identification of novel β-1,3-glucan synthase inhibitors using pharmacophore and 3D-QSAR methodologies

S. no

ZINC database ID

Compound (synthetic)

Fitness score

1

ZINC40390784

2.13

2

ZINC57742232

2.12

3

ZINC09823898

2.10

4

ZINC09087176

2.09

5

ZINC21010902

2.08

6

ZINC18222209

2.06

7

ZINC81275318

2.05

8

ZINC03522823

2.05

9

ZINC12140774

2.03

10

ZINC69708581

2.00

11

ZINC72283844

2.00

S. no

ZINC database ID

Compound (natural product)

Fitness score

12

ZINC38269114

1.76

13

ZINC13375730

1.74

14

ZINC13375727

1.61

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