IUPAC Name :(4S)-4-amino-5-[2-(1H-indol-3-yl)ethylamino]-5-oxopentanoic acid
InChI :InChI=1/C15H19N3O3/c16-12(5-6-14(19)20)15(21)17-8-7-10-9-18-13-4-2-1-3-11(10)13/h1-4,9,12,18H,5-8,16H2,(H,17,21)(H,19,20)/t12-/m0/s1
Std.InChI: InChI=1S/C15H19N3O3/c16-12(5-6-14(19)20)15(21)17-8-7-10-9-18-13-4-2-1-3-11(10)13/h1-4,9,12,18H,5-8,16H2,(H,17,21)(H,19,20)/t12-/m0/s1
InChIKey :WAACXEZYKFZHHH-LBPRGKRZBF
Std.InChIKey: WAACXEZYKFZHHH-LBPRGKRZSA-N
SMILES :C1=CC=C2C(=C1)C(=CN2)CCNC(=O)[C@H](CCC(=O)O)N
Molar Refractivity :77.15 ± 0.5 cm3 (est)
Parachor :587.5 ± 8.0 cm3 (est)
Index of Refraction :1.636 ± 0.05
(est)
Surface Tension :55.6 ± 7.0 dyne/cm (est)
Density :1.34 ± 0.1 g/cm3 (est)
Polarizability :30.58 ± 0.5 10-24cm3 (est)