| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 16th, 2008 | 24 | No |
Popular Name: 2-[4,7-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic 2-[4,7-bis(carboxymethyl)-1,4,7,…
| 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) | -4.83 | 2.56 | -87.76 | 3 | 10 | -1 | 145 | 345.376 | 6 | ↓ |
| Mid Mid (pH 6-8) | -4.83 | 4.25 | -126.54 | 4 | 10 | 0 | 146 | 346.384 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0708761A1; EP0755385A1; US5679810; US5798089 | IBM Patent Data |
