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Organic and Medicinal Chemistry Letters

Table 1 List of hits obtained from the MiniMaybridge and NCI database with their corresponding fit value and estimated activity

From: In silico identification of novel lead compounds with AT1 receptor antagonist activity: successful application of chemical database screening protocol

Number

Hits retrieved

Fit value

Estimated activity (nM)

1 (MiniMaybridge HITS)

SP 01066

9.239

0.205

2

KM 09509

8.524

1.062

3(NCI HITS)

NSC 122371

9.517

0.108

4

NSC 157629

9.515

0.108

5

NSC 90956

9.356

0.156

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