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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
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Analogs

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Popular Name: 2-(cyclopentylamino)-9-(1-methyl-4-piperidyl)-5,6-dihydropyrrolo[3,2-h]quinazoline-7-carboxamide 2-(cyclopentylamino)-9-(1-methyl…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
CCNA1-1-E Cyclin A1 (cluster #1 Of 3), Eukaryotic Eukaryotes 6 0.40 Binding ≤ 10μM
CCNA2-1-E Cyclin A2 (cluster #1 Of 3), Eukaryotic Eukaryotes 6 0.40 Binding ≤ 10μM
CDK2-1-E Cyclin-dependent Kinase 2 (cluster #1 Of 5), Eukaryotic Eukaryotes 6 0.40 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
CCNA1_HUMAN P78396 Cyclin A1, Human 5.99791076 0.40 Binding ≤ 1μM
CCNA2_HUMAN P20248 Cyclin A2, Human 5.99791076 0.40 Binding ≤ 1μM
CDK2_HUMAN P24941 Cyclin-dependent Kinase 2, Human 5.99791076 0.40 Binding ≤ 1μM
CCNA1_HUMAN P78396 Cyclin A1, Human 5.99791076 0.40 Binding ≤ 10μM
CCNA2_HUMAN P20248 Cyclin A2, Human 5.99791076 0.40 Binding ≤ 10μM
CDK2_HUMAN P24941 Cyclin-dependent Kinase 2, Human 5.99791076 0.40 Binding ≤ 10μM

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.84 10.29 -54.48 4 7 1 90 395.531 4 ↓
Hi High (pH 8-9.5) 1.84 7.92 -11.86 3 7 0 89 394.523 4 ↓