In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 20 | Yes |
Popular Name: 3-[2-[(tert-butoxycarbonylamino)methyl]phenyl]propanoic 3-[2-[(tert-butoxycarbonylamino)…
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) | 2.43 | 7.17 | -51.67 | 1 | 5 | -1 | 78 | 278.328 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.43 | 5.2 | -9.05 | 2 | 5 | 0 | 76 | 279.336 | 7 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4297489 | IBM Patent Data |