32U/PRD_000600

D-phenylalanyl-N-{4-[amino(iminio)methyl]benzyl}-L-prolinamide

32U/PRD_000600 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).

The representative PDB ID is 2ZDA.

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Chemical Component Summary
Name	D-phenylalanyl-N-{4-[amino(iminio)methyl]benzyl}-L-prolinamide
Identifiers	[azanyl-[4-[[[(2S)-1-[(2R)-2-azanyl-3-phenyl-propanoyl]pyrrolidin-2-yl]carbonylamino]methyl]phenyl]methylidene]azanium
Formula	C₂₂ H₂₈ N₅ O₂
Molecular Weight	394.49
Type	PEPTIDE-LIKE
Isomeric SMILES	c1ccc(cc1)C[C@H](C(=O)N2CCC[C@H]2C(=O)NCc3ccc(cc3)C(=[NH2+])N)N
InChI	InChI=1S/C22H27N5O2/c23-18(13-15-5-2-1-3-6-15)22(29)27-12-4-7-19(27)21(28)26-14-16-8-10-17(11-9-16)20(24)25/h1-3,5-6,8-11,18-19H,4,7,12-14,23H2,(H3,24,25)(H,26,28)/p+1/t18-,19+/m1/s1
InChIKey	VZFTWWJAUZOJDH-MOPGFXCFSA-O
Composition	Polymer Sequences: DPN-PRO-00S
BIRD class	THROMBIN INHIBITOR
Represented As	SINGLE MOLECULE
Compound Details	n/a
Description	n/a

Chemical Details
Formal Charge	1
Atom Count	57
Chiral Atom Count	2
Bond Count	59
Aromatic Bond Count	12

Drug Info: DrugBank

DrugBank ID	DB07005 ?
Name	D-phenylalanyl-N-{4-[amino(iminio)methyl]benzyl}-L-prolinamide
Groups	experimental
Synonyms	D-phenylalanyl-N-{4-[amino(iminio)methyl]benzyl}-L-prolinamide

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Prothrombin	MAHVRGLQLPGCLALAALCSLVHSQHVFLAPQQARSLLQRVRRANTFLEE...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682