ROLIPRAM

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Search structure


Synonyms	(r,s)-rolipram NSC-760125 Rolipram SB-95952 ZK 62 711 ZK-62711 ZK-62771
Status
Molecule Category	Free-form
UNII	K676NL63N7
EPA CompTox	DTXSID3044124

Structure


InChI Key	HJORMJIFDVBMOB-UHFFFAOYSA-N
Smiles	COc1ccc(C2CNC(=O)C2)cc1OC1CCCC1
InChI	InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C16H21NO3
Molecular Weight	275.35
AlogP	2.62
Hydrogen Bond Acceptor	3.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	4.0
Polar Surface Area	47.56
Molecular species	NEUTRAL
Aromatic Rings	1.0
Heavy Atoms	20.0

Pharmacology

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Enzyme Phosphodiesterase Phosphodiesterase 1 Phosphodiesterase 1A	-	-	-	-	8
Enzyme Phosphodiesterase Phosphodiesterase 1 Phosphodiesterase 1B	-	-	-	-	8
Enzyme Phosphodiesterase Phosphodiesterase 1 Phosphodiesterase 1C	-	-	-	-	8
Enzyme Phosphodiesterase Phosphodiesterase 2 Phosphodiesterase 2A	-	-	-	-	5-28
Enzyme Phosphodiesterase Phosphodiesterase 3 Phosphodiesterase 3A	-	-	-	-	9.42-27
Enzyme Phosphodiesterase Phosphodiesterase 3 Phosphodiesterase 3B	-	-	-	-	14-27
Enzyme Phosphodiesterase Phosphodiesterase 4 Phosphodiesterase 4A	500	0.31-930	10	0.0023-800	67.41-106
Enzyme Phosphodiesterase Phosphodiesterase 4 Phosphodiesterase 4B	160-220	0.31-941	10	0.0023-800	65-106
Enzyme Phosphodiesterase Phosphodiesterase 4 Phosphodiesterase 4C	-	0.31-930	10	0.0023-800	40-106
Enzyme Phosphodiesterase Phosphodiesterase 4 Phosphodiesterase 4D	670	0.31-930	10	0.0023-930	67.41-106
Enzyme Phosphodiesterase Phosphodiesterase 5 Phosphodiesterase 5A	-	720	-	-	-
Enzyme Phosphodiesterase Phosphodiesterase 7 Phosphodiesterase 7A	-	-	-	-	3.1
Ion channel Voltage-gated ion channel Voltage-gated sodium channel	-	-	-	-	3.1-8.5
Secreted protein	-	200-500	-	-	50.3

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Bos taurus	-	100-800	-	-	-
Canis lupus familiaris	-	800	-	-	28
Cavia porcellus	26.3-69.18	20-590	-	3.8-4.5	3.1-95.4
Cercopithecidae	-	-	-	-	33.4-84
Homo sapiens	130-670	4-941	-	1.6-930	3.1-106
Mus musculus	-	4-190	-	-	6-96
Rattus norvegicus	-	2-600	-	2.1-11	16-41
Sus scrofa	-	720	-	-	-
Zika virus	-	44.6	-	-	-

Cross References

Resources	Reference
ChEBI	104872
ChEMBL	CHEMBL63
DrugBank	DB01954
FDA SRS	K676NL63N7
Guide to Pharmacology	5260
PubChem	5092
SureChEMBL	SCHEMBL27930

CONTENTS

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