EcoDrugPlus


Synonyms	Dapiprazole
Status
Molecule Category	Free-form
ATC	S01EX02
UNII	5RNZ8GJO7K
EPA CompTox	DTXSID90223140

Synonyms

Dapiprazole

Status

Molecule Category

Free-form

ATC

S01EX02

UNII

5RNZ8GJO7K

EPA CompTox

DTXSID90223140


InChI Key	RFWZESUMWJKKRN-UHFFFAOYSA-N
Smiles	Cc1ccccc1N1CCN(CCc2nnc3n2CCCC3)CC1
InChI	InChI=1S/C19H27N5/c1-16-6-2-3-7-17(16)23-14-12-22(13-15-23)11-9-19-21-20-18-8-4-5-10-24(18)19/h2-3,6-7H,4-5,8-15H2,1H3

InChI Key

RFWZESUMWJKKRN-UHFFFAOYSA-N

Smiles

Cc1ccccc1N1CCN(CCc2nnc3n2CCCC3)CC1

InChI

InChI=1S/C19H27N5/c1-16-6-2-3-7-17(16)23-14-12-22(13-15-23)11-9-19-21-20-18-8-4-5-10-24(18)19/h2-3,6-7H,4-5,8-15H2,1H3

Property Name	Value
Molecular Formula	C19H27N5
Molecular Weight	325.46
AlogP	2.29
Hydrogen Bond Acceptor	5.0
Number of Rotational Bond	4.0
Polar Surface Area	37.19
Molecular species	NEUTRAL
Aromatic Rings	2.0
Heavy Atoms	24.0

Property Name

Value

Molecular Formula

C19H27N5

Molecular Weight

325.46

AlogP

2.29

Hydrogen Bond Acceptor

5.0

Number of Rotational Bond

4.0

Polar Surface Area

37.19

Molecular species

NEUTRAL

Aromatic Rings

2.0

Heavy Atoms

24.0

Resources	Reference
ChEBI	51066
ChEMBL	CHEMBL1201216
DrugBank	DB00298
DrugCentral	781
FDA SRS	5RNZ8GJO7K
Human Metabolome Database	HMDB0014443
Guide to Pharmacology	7155
PharmGKB	PA164749109
PubChem	3033538
SureChEMBL	SCHEMBL152543
ZINC	ZINC000000001246

Resources

Reference

ChEBI

ChEMBL

DrugBank

DrugCentral

FDA SRS

Human Metabolome Database

HMDB0014443

Guide to Pharmacology

PharmGKB

PubChem

SureChEMBL

ZINC

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...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

DAPIPRAZOLE

Structure

Physicochemical Descriptors

Cross References