Bioactive Compound Details

BioIDbio142420
NameLACIDIPINE
ChEMBL IDCHEMBL460291
Molecular FormulaC26H33NO6
Molecular Weight455.55
Molecular Weight (Monoisotopic)455.2308
TypeSmall molecule
Max PhasePhase 4
Target IDTar65
Target NameNone
Synonyms3,3'-IMINOBISPROPYLAMINE|3,3'-IMINODIPROPYLAMINE|4-AZAHEPTAMETHYLENEDIAMINE|CALDINE|DIPROPYLAMINE, 3,3'-DIAMINO-|DIPROPYLENETRIAMINE|GR 43659X|GR-43659X|LACIDIPINE|LACIDIPINO|MOLAP|MOTENS|NSC-7773
SmilesCCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1ccccc1/C=C/C(=O)OC(C)(C)C
InchiInChI=1S/C26H33NO6/c1-8-31-24(29)21-16(3)27-17(4)22(25(30)32-9-2)23(21)19-13-11-10-12-18(19)14-15-20(28)33-26(5,6)7/h10-15,23,27H,8-9H2,1-7H3/b15-14+
Inchi KeyGKQPCPXONLDCMU-CCEZHUSRSA-N
Molecular SpeciesNEUTRAL
Targets165.0
Bioactivities957.0
Np Likeness Score-0.23
Records Key['Lacidipine', 'Lacidipine', 'Lacidipine', 'LACIDIPINE', 'SID170465580', 'Lacidipine', 'Lacidipine', 'SID144205727', 'Lacidipine', 'LACIDIPINE', 'LACIDIPINE', 'Lacidipine', 'Lacidipine', 'lacidipine', 'LACIDIPINE', 'Lacidipine脢', 'Lacidipine (Lacipil; Motens)', 'Lacidipine', 'LACIDIPINE (LACIPIL, MOTENS)', 'LACIDIPINE', 'Lacidipine (Lacipil; Motens)', 'Lacidipine脗', 'LACIDIPINE', 'LACIDIPINE', 'SAM001246648', 'Lacidipine (Lacipil; Motens)', 'COVC-0677970346', 'BA1001079', 'lacidipine']
Records Name['Lacidipine', 'Lacidipine', 'Lacidipine', 'Lacidipine', 'SID170465580', 'Lacidipine', 'Lacidipine', 'SID144205727', 'Lacidipine', 'LACIDIPINE', 'LACIDIPINE', 'Lacidipine', 'Lacidipine', 'lacidipine', 'LACIDIPINE', 'Lacidipine脢', 'Lacidipine (Lacipil; Motens)', 'Lacidipine', 'LACIDIPINE (LACIPIL, MOTENS)', 'LACIDIPINE', 'Lacidipine (Lacipil; Motens)', 'Lacidipine脗', 'LACIDIPINE', 'LACIDIPINE', 'C0164851', 'Lacidipine (Lacipil; Motens)', 'LACIDIPINE', None, 'lacidipine']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure