In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2004 | 22 | Yes |
Popular Name: tert-butyl-[(2R)-3-[(2S,3S)-2,3-dihydroxytetralin-5-yl]oxy-2-hydroxy-propyl]ammonium tert-butyl-[(2R)-3-[(2S,3S)-2,3-…
None
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) | 1.15 | -7.11 | -43.59 | 5 | 5 | 1 | 87 | 310.414 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4302453; US4350812 | IBM Patent Data |