trivial
MMB-2201
5-FLUORO-AMB-PICA
systemic
('S')-Methyl 2-(1-(5-fluoropentyl)-1H-indole-3-carboxamido)-3-methylbutanoate
MMB-2201
5-FLUORO-AMB-PICA
systemic
('S')-Methyl 2-(1-(5-fluoropentyl)-1H-indole-3-carboxamido)-3-methylbutanoate
Identifiers
InChIKey: JFXASAFVUQVGEW-SFHVURJKSA-N
Formula: C20H27FN2O3
CAS Registry numbers:
1616253-26-9
Descriptors
Bioavailability-related
Molecular weight: 362.20 DaPartition coefficient: 3.71
H bond donors: 1
H bond acceptors: 5
Rotatable bonds: 11
Molar refractivity: 99.87 J mol-1 K-1
Polar surface area: 60.33 Å2
Generic
Stereocenters: 1Heteroatoms: 6
Spiroatoms: 0
Bridge atoms: 0
Amide bonds: 1
Ring-related
Rings: 2Heterocycles: 1
Aromatic rings: 2
Aromatic carbocycles: 1
Aromatic heterocycles: 1
Aliphatic rings: 0
Aliphatic carbocycles: 0
Aliphatic heterocycles: 0