| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 18th, 2013 | 24 | No |
Popular Name: Ethylenebis(nitrilodimethylene)tetraphosphonic acid Ethylenebis(nitrilodimethylene)t…
Find On: PubMed — Wikipedia — Google
CAS Number: 1429-50-1
| 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) | -4.54 | -6.76 | -278.74 | 4 | 14 | -4 | 248 | 432.092 | 11 | ↓ |
| Hi High (pH 8-9.5) | -4.54 | -2.3 | -984.82 | 0 | 14 | -8 | 259 | 428.06 | 11 | ↓ |
| Hi High (pH 8-9.5) | -4.54 | -3.42 | -760.67 | 1 | 14 | -7 | 256 | 429.068 | 11 | ↓ |
| Hi High (pH 8-9.5) | -4.54 | -3.43 | -793.11 | 1 | 14 | -7 | 256 | 429.068 | 11 | ↓ |
| Mid Mid (pH 6-8) | -4.54 | -5.65 | -419.84 | 3 | 14 | -5 | 251 | 431.084 | 11 | ↓ |
| Mid Mid (pH 6-8) | -4.54 | -5.66 | -426.5 | 3 | 14 | -5 | 251 | 431.084 | 11 | ↓ |
| Mid Mid (pH 6-8) | -4.54 | -5.38 | -293.28 | 4 | 14 | -4 | 252 | 432.092 | 11 | ↓ |
No pre-computed analogs available. Try a structural similarity search.