WF14865B

AlkaPlorer ID: AK034096

Synonym: None

IUPAC Name: (2S,3S)-3-[[(2S)-1-[3-(2-amino-1H-imidazol-5-yl)propylamino]-4-methyl-1-oxopentan-2-yl]carbamoyl]oxirane-2-carboxylic acid

Structure

SMILES: CC(C)C[C@H](N=C(O)[C@H]1O[C@@H]1C(=O)O)C(O)=NCCCC1=CNC(=N)N1

copy

InChI: InChI=1S/C16H25N5O5/c1-8(2)6-10(21-14(23)11-12(26-11)15(24)25)13(22)18-5-3-4-9-7-19-16(17)20-9/h7-8,10-12H,3-6H2,1-2H3,(H,18,22)(H,21,23)(H,24,25)(H3,17,19,20)/t10-,11-,12-/m0/s1

copy

InChIKey: ANTVWDOUZRJATD-SRVKXCTJSA-N

copy

Properties Information

Molecule Weight: 367.40600000000006

TPSA: 170.44

MolLogP: 0.9345700000000016

Number of H-Donors: 6

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information