In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 6th, 2008 | 14 | Yes |
Popular Name: (2S)-2-(cyclohexylformamido)propanoic acid (2S)-2-(cyclohexylformamido)prop…
Find On: PubMed — Wikipedia — Google
CAS Number: 180991-54-2
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | -0.17 | 4.71 | -42.27 | 1 | 4 | -1 | 69 | 198.242 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 127 - 129 | Enamine Building Blocks |
MP | 127...129 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
PUBCHEM_PATENT_ID | US5179125; US5210266 | IBM Patent Data |