(3R)-3-[({[(1S)-1-[(4-carbamimidamidobutyl)carbamoyl]-3-methylbutyl]carbamoyl}methyl)(sulfo)amino]-N-(5-carbamimidamidopentyl)decanamide
AlkaPlorer ID: AK000231
Synonym: None
IUPAC Name: [2-[[(2S)-1-[4-(diaminomethylideneamino)butylamino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]-[1-[5-(diaminomethylideneamino)pentylamino]-1-oxodecan-3-yl]sulfamic acid
Structure
SMILES: CCCCCCCC(CC(O)=NCCCCCNC(=N)N)N(CC(O)=N[C@@H](CC(C)C)C(O)=NCCCCNC(=N)N)S(=O)(=O)O
InChI: InChI=1S/C29H60N10O6S/c1-4-5-6-7-9-14-23(20-25(40)34-15-10-8-11-17-36-28(30)31)39(46(43,44)45)21-26(41)38-24(19-22(2)3)27(42)35-16-12-13-18-37-29(32)33/h22-24H,4-21H2,1-3H3,(H,34,40)(H,35,42)(H,38,41)(H4,30,31,36)(H4,32,33,37)(H,43,44,45)/t23?,24-/m0/s1
InChIKey: SDOICZAARKNQBK-CGAIIQECSA-N
Source
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Properties Information
Molecule Weight: 676.9300000000002
TPSA？: 279.18
MolLogP？: 3.411240000000008
Number of H-Donors: 10
Number of H-Acceptors: 7
RingCount: 0
Activities Information
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