AC1L2SDH

N-[(2S)-1-[4-(3-aminopropylamino)butylamino]-3-hydroxy-1-oxopropan-2-yl]-4-[4-(diaminomethylideneamino)phenyl]butanamide

Also Known As: N 30|N-30|10-(N-(4-(4-Guanidinophenyl)butanoyl)-L-seryl)-1,5,10-triazadecane|N-[(2S)-1-[4-(3-aminopropylamino)butylamino]-3-hydroxy-1-oxopropan-2-yl]-4-[4-(diaminomethylideneamino)phenyl]butanamide|Benzenebutanamide, 4-((aminoiminomethyl)amino)-N-(2-((4-((3-aminopropyl)amino)butyl)amino)-1-(hydroxymethyl)-2-oxoethyl)-, (S)-|4-[(Aminoiminomethyl)amino]-N-[(S)-2-[[4-[(3-aminopropyl)amino]butyl]amino]-1-(hydroxymethyl)-2-oxoethyl]benzenebutanamide|Benzenebutanamide,4-[(aminoiminomethyl)amino]-N-[(1S)-2-[[4-[(3-aminopropyl)amino]butyl]amino]-1-(hydroxymethyl)-2-oxoethyl]-|N-(1-((4-((3-Aminopropyl)amino)butyl)imino)-1,3-dihydroxypropan-2-yl)-4-(4-carbamimidamidophenyl)butanimidic acid|N-[(1S)-1-({4-[(3-AMINOPROPYL)AMINO]BUTYL}CARBAMOYL)-2-HYDROXYETHYL]-4-(4-CARBAMIMIDAMIDOPHENYL)BUTANAMIDE|N-[(2S)-1-({4-[(3-Aminopropyl)amino]butyl}imino)-1,3-dihydroxypropan-2-yl]-4-[4-(carbamimidoylamino)phenyl]butanimidic acid|N-[1-({4-[(3-Aminopropyl)amino]butyl}imino)-1,3-dihydroxypropan-2-yl]-4-(4-carbamimidamidophenyl)butanimidic acid

Molecular Formula	C21H37N7O3
Molecular Weight	435.29578 g/mol
LogP	-1.3
Topological Polar Surface Area	181.0 Ų
Hydrogen Bond Donors	7
Hydrogen Bond Acceptors	6
Rotatable Bonds	16
Exact Mass	435.29578
Monoisotopic Mass	435.29578
Heavy Atoms	31
Complexity	533.0

Chemical Identifiers

CAS Number	100511-49-7
SMILES	C1=CC(=CC=C1CCCC(=O)N[C@@H](CO)C(=O)NCCCCNCCCN)N=C(N)N
InChIKey	XERMVRJWJCKFMG-SFHVURJKSA-N