Standard InChI: InChI=1S/C21H25ClN6O2/c22-15-3-1-14(2-4-15)17(6-12-29)27-20(30)21(23)7-10-28(11-8-21)19-16-5-9-24-18(16)25-13-26-19/h1-5,9,13,17,29H,6-8,10-12,23H2,(H,27,30)(H,24,25,26)/t17-/m0/s1 (Source: PubChem)

IUPAC Name: 4-amino-N-[(1S)-1-(4-chlorophenyl)-3-hydroxypropyl]-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide (Source: PubChem)

PubChem CID: 25227436 (Source: PubChem)

SMILES String: C1CN(CCC1(C(=O)N[C@@H](CCO)C2=CC=C(C=C2)Cl)N)C3=NC=NC4=C3C=CN4 (Source: PubChem)

Connectivity SMILES string: C1CN(CCC1(C(=O)NC(CCO)C2=CC=C(C=C2)Cl)N)C3=NC=NC4=C3C=CN4 (Source: PubChem)

Standard InChIKey: JDUBGYFRJFOXQC-KRWDZBQOSA-N (Source: PubChem)

CAS Registry Number: 1143532-39-1 (Source: PubChem)

ChEBI ID: CHEBI:229222 (Source: PubChem)

ChEMBL ID: CHEMBL2325741 (Source: PubChem)

CompTox Dashboard Compound ID: DTXCID4073201 (Source: PubChem)

CompTox Dashboard Substance ID: DTXSID40150710 (Source: PubChem)

Wikidata ID: Q27074756 (Source: PubChem)

WHO ATC Classification Drug Code: L01EX27 (Source: ChEMBL)

WHO ATC Classification Drug Name: Capivasertib (Source: ChEMBL)

Connectivity SMILES string: NC1(C(=O)N[C@@H](CCO)c2ccc(Cl)cc2)CCN(c2nc[nH]c3nccc2-3)CC1 (Source: ChEMBL)

European Medicines Agency Name: Capivasertib (Source: ChEMBL)

International Nonproprietary Name: Capivasertib (Source: ChEMBL)

Preferred Name: CAPIVASERTIB (Source: ChEMBL)

Standard InChI: InChI=1S/C21H25ClN6O2/c22-15-3-1-14(2-4-15)17(6-12-29)27-20(30)21(23)7-10-28(11-8-21)19-16-5-9-24-18(16)25-13-26-19/h1-5,9,13,17,29H,6-8,10-12,23H2,(H,27,30)(H,24,25,26)/t17-/m0/s1 (Source: ChEMBL)

Standard InChIKey: JDUBGYFRJFOXQC-KRWDZBQOSA-N (Source: ChEMBL)

US Adopted Name: Capivasertib (Source: ChEMBL)

Molecule statistics: 1 (Source: PubChem)

Molecule statistics: 0 (Source: PubChem)

Thermodynamic parameters: 1.7 (Source: PubChem)

Molecule statistics: 1 (Source: PubChem)

Molecule statistics: 1 (Source: PubChem)

Molecule statistics: 0 (Source: PubChem)

Mass parameters: 428.1727518 Da (Source: PubChem)

Molecule statistics: 30 (Source: PubChem)

Molecule statistics: 6 (Source: PubChem)

Molecule statistics: 4 (Source: PubChem)

Molecule statistics: 0 (Source: PubChem)

Surface parameters: 0 (Source: PubChem)

Stuctural analysis: 580 (Source: PubChem)

Stuctural analysis: 319.3 (Source: PubChem)

Mass parameters: 428.9 g/mol (Source: PubChem)

Mass parameters: 428.1727518 Da (Source: PubChem)

Molecule statistics: 6 (Source: PubChem)

Surface parameters: 120 Ų (Source: PubChem)

Molecule statistics: 0 (Source: PubChem)

Molecule statistics: 0 (Source: PubChem)

Thermodynamic parameters: 1 (Source: ChEMBL)

Thermodynamic parameters: 2.10 (Source: ChEMBL)

Molecule statistics: 30 (Source: ChEMBL)

Molecule statistics: 6 (Source: ChEMBL)

Molecule statistics: 4 (Source: ChEMBL)

Mass parameters: 428.92 g/mol (Source: ChEMBL)

Mass parameters: 428.92 g/mol (Source: ChEMBL)

Molecule statistics: -0.43 (Source: ChEMBL)

Molecule statistics: 120.16 (Source: ChEMBL)

Molecule statistics: 0.48 (Source: ChEMBL)

Molecule statistics: 6 (Source: ChEMBL)

Chemical formula: C21H25ClN6O2 (Source: PubChem)

Chirality: 1 (Source: ChEMBL)

Chemical formula: C21H25ClN6O2 (Source: ChEMBL)

Molecule type: Small molecule (Source: ChEMBL)

Natural product: 1 (Source: ChEMBL)

Passes the rule of three : N (Source: ChEMBL)

USAN STEM Defintion: serine/threonine kinase inhibitors (Source: ChEMBL)

USAN STEM: -sertib (Source: ChEMBL)