In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 26th, 2011 | 22 | No |
Popular Name: 2-[7-(carboxymethyl)-4,10-dimethyl-1,4,7,10-tetrazacyclododec-1-yl]acetic 2-[7-(carboxymethyl)-4,10-dimeth…
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) | -3.04 | 3.14 | -60.33 | 2 | 8 | 0 | 96 | 316.402 | 4 | ↓ |
Hi High (pH 8-9.5) | -3.04 | 0.15 | -73.34 | 1 | 8 | -1 | 94 | 315.394 | 4 | ↓ |
Lo Low (pH 4.5-6) | -3.04 | 3.62 | -101.15 | 2 | 8 | 0 | 96 | 316.402 | 4 | ↓ |
Lo Low (pH 4.5-6) | -3.04 | 1.65 | -87.95 | 3 | 8 | 1 | 93 | 317.41 | 4 | ↓ |