| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 14th, 2012 | 9 | No |
Popular Name: AMINOPROPYL DIHYDROGEN PHOSPHATE AMINOPROPYL DIHYDROGEN PHOSPHATE
Find On: PubMed — Wikipedia — Google
CAS Number: 1071-28-9
| 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) | -0.72 | -1.58 | -99.44 | 3 | 5 | -1 | 100 | 154.082 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.72 | -2.5 | -135.63 | 2 | 5 | -2 | 98 | 153.074 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.72 | -2.74 | -40.77 | 4 | 5 | 0 | 97 | 155.09 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5738969 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.