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N,3-dimethyl-2H-pyrazolo[4,3-d]pyrimidin-7-amine ID: ALA5177286
Chembl Id: CHEMBL5177286
Cas Number: 1205610-59-8
PubChem CID: 52149316
Max Phase: Preclinical
Molecular Formula: C7H9N5
Molecular Weight: 163.18
Associated Items:
Names and Identifiers Canonical SMILES: CNc1ncnc2c(C)[nH]nc12
Standard InChI: InChI=1S/C7H9N5/c1-4-5-6(12-11-4)7(8-2)10-3-9-5/h3H,1-2H3,(H,11,12)(H,8,9,10)
Standard InChI Key: SUUWWTXOJILAMU-UHFFFAOYSA-N
Associated Targets(Human) Molecule Features Natural Product: NoOral: NoChemical Probe: NoParenteral: NoMolecule Type: Topical: NoFirst In Class: NoBlack Box: NoChirality: NoAvailability: NoProdrug: No
Drug Indications MESH ID MESH Heading EFO IDs EFO Terms Max Phase for Indication References
Mechanisms of Action Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References
Calculated Properties Molecular Weight: 163.18Molecular Weight (Monoisotopic): 163.0858AlogP: 0.70#Rotatable Bonds: 1Polar Surface Area: 66.49Molecular Species: NEUTRALHBA: 4HBD: 2#RO5 Violations: ┄HBA (Lipinski): 5HBD (Lipinski): 2#RO5 Violations (Lipinski): ┄CX Acidic pKa: 12.41CX Basic pKa: 0.96CX LogP: 0.38CX LogD: 0.38Aromatic Rings: 2Heavy Atoms: 12QED Weighted: 0.65Np Likeness Score: -1.24