In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2012 | 14 | Yes |
Popular Name: (S)-tert-Butyl(1-hydroxy-3-oxobutan-2-yl)carbamate (S)-tert-Butyl(1-hydroxy-3-oxobu…
Find On: PubMed — Wikipedia — Google
CAS Number: 477191-17-6
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) | 1.83 | -0.36 | -12.24 | 2 | 5 | 0 | 76 | 203.238 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0394989A2; EP0394989B1; US4742047; US4789731; US5164372; US5420297; US5633232; WO1992022569A1; WO1994020126A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.