General Information of the Compound
Compound ID
CP0046380
Compound Name
(-)-rolipram
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Synonyms
(4R)-4-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]PYRROLIDIN-2-ONE
(R)-(-)-Rolipram
(R)-ROLIPRAM
(R)-Rolipram
1q9m
1ro6
1xmy
3g4k
85416-75-7
AC1L9LJS
BCP14111
CAS-61413-54-5
CHEBI:40133
CHEMBL430893
DPX51KUP08
HMS3267P19
KS-00000QDB
Lopac-R-6520
MolPort-003-983-801
NCGC00016899-01
PubChem18284
R-Rolipram
SCHEMBL576805
Tocris-0905
Tocris-1349
Tocris-1350
UNII-DPX51KUP08
ZINC4982
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Structure
Formula
C16H21NO3
Molecular Weight
275.348
Canonical SMILES
COc1ccc(cc1OC1CCCC1)[C@@H]1CNC(=O)C1
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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)/t12-/m0/s1
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InChIKey
HJORMJIFDVBMOB-LBPRGKRZSA-N
Physicochemical Property
logP
2.6201
Rotatable Bonds
4
Heavy Atom Count
20
Polar Areas
47.56
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Complexity
20

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 448055
SID: 16133703
ChEMBL ID
CHEMBL430893
DrugBank ID
DB04149
Clinical Information about the Compound
Drug 1 ( (R)-Rolipram )
Drug Name (R)-Rolipram
Target(s)
Phosphodiesterase 4A (PDE4A)
Inhibitor
Phosphodiesterase 4B (PDE4B)
Inhibitor