CID 172854398

CaKSeZn — CID 172854398

IUPAC—
SMILES[Ca].[K].[Se].[Zn]
InChIInChI=1S/Ca.K.Se.Zn
InChIKeyYMPZACKOTOBIMQ-UHFFFAOYSA-N
MW223.53 g/mol
LogP-1.14
Rot. Bonds

About CID 172854398

CID 172854398 (PubChem CID 172854398) has the molecular formula CaKSeZn and a molecular weight of 223.53 g/mol.

Molecular Properties

Compound NameCID 172854398
PubChem CID172854398
Molecular FormulaCaKSeZn
Molecular Weight223.53 g/mol
Exact Mass222.77
IUPAC Name—
SMILES[Ca].[K].[Se].[Zn]
InChIInChI=1S/Ca.K.Se.Zn
InChIKeyYMPZACKOTOBIMQ-UHFFFAOYSA-N
XLogP-1.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.53
LogP ≤ 5-1.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 172854398?
The IUPAC name of CID 172854398 (CID 172854398) is not available.
What is the SMILES notation for CID 172854398?
The canonical SMILES for CID 172854398 is [Ca].[K].[Se].[Zn].
What is the InChIKey of CID 172854398?
The InChIKey is YMPZACKOTOBIMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/Ca.K.Se.Zn.
What are the key properties of CID 172854398?
CID 172854398 has a molecular weight of 223.53 g/mol, XLogP of -1.14, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 172854398 is sourced from PubChem (CID 172854398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).