EcoDrugPlus


Synonyms	SPR-994 SPR994 Spr994 TBPM-PI-HBr Tebipenem pivoxil hydrobromide
Status
Molecule Category	Salt-form
UNII	NT65DX774J

Synonyms

SPR-994

SPR994

Spr994

TBPM-PI-HBr

Tebipenem pivoxil hydrobromide

Status

Molecule Category

Salt-form

UNII

NT65DX774J


InChI Key	MMWWBQNLJKFAIN-HXLQFWNVSA-N
Smiles	Br.C[C@@H](O)[C@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(SC3CN(C4=NCCS4)C3)[C@H](C)[C@H]12
InChI	InChI=1S/C22H31N3O6S2.BrH/c1-11-15-14(12(2)26)18(27)25(15)16(19(28)30-10-31-20(29)22(3,4)5)17(11)33-13-8-24(9-13)21-23-6-7-32-21;/h11-15,26H,6-10H2,1-5H3;1H/t11-,12-,14-,15-;/m1./s1

InChI Key

MMWWBQNLJKFAIN-HXLQFWNVSA-N

Smiles

Br.C[C@@H](O)[C@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(SC3CN(C4=NCCS4)C3)[C@H](C)[C@H]12

InChI

InChI=1S/C22H31N3O6S2.BrH/c1-11-15-14(12(2)26)18(27)25(15)16(19(28)30-10-31-20(29)22(3,4)5)17(11)33-13-8-24(9-13)21-23-6-7-32-21;/h11-15,26H,6-10H2,1-5H3;1H/t11-,12-,14-,15-;/m1./s1

Property Name	Value
Molecular Formula	C22H32BrN3O6S2
Molecular Weight	578.55
AlogP	1.67
Hydrogen Bond Acceptor	10.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	6.0
Polar Surface Area	108.74
Molecular species	NEUTRAL
Aromatic Rings	0.0
Heavy Atoms	33.0

Property Name

Value

Molecular Formula

C22H32BrN3O6S2

Molecular Weight

578.55

AlogP

1.67

Hydrogen Bond Acceptor

10.0

Hydrogen Bond Donor

1.0

Number of Rotational Bond

6.0

Polar Surface Area

108.74

Molecular species

NEUTRAL

Aromatic Rings

0.0

Heavy Atoms

33.0

Resources	Reference
ChEMBL	CHEMBL4297677
FDA SRS	NT65DX774J

Resources

Reference

ChEMBL

CHEMBL4297677

FDA SRS

NT65DX774J

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

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Last update: Monday, 3 November 2025

TEBIPENEM PIVOXIL HYDROBROMIDE

Structure

Physicochemical Descriptors

Cross References