In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2010 | 27 | Yes |
Popular Name: N-[(2R)-2-benzyloxy-3-(1-naphthyloxy)propyl]-2-methyl-propan-2-amine N-[(2R)-2-benzyloxy-3-(1-naphthy…
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) | 5.69 | 12.22 | -41.57 | 2 | 3 | 1 | 35 | 364.509 | 9 | ↓ |
Hi High (pH 8-9.5) | 5.69 | 11.66 | -7.68 | 1 | 3 | 0 | 30 | 363.501 | 9 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4018824; US4360464 | IBM Patent Data |