| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 30th, 2008 | 20 | Yes |
Popular Name: (S,S)-Ethylenediamine-N,N'-disuccinicacidtrisodiumsaltsolution (S,S)-Ethylenediamine-N,N'-disuc…
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CAS Number: 178949-82-1
| 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) | -4.93 | 3.96 | -171.52 | 3 | 10 | -3 | 189 | 289.22 | 11 | ↓ |
| Hi High (pH 8-9.5) | -4.93 | 2.13 | -122.89 | 4 | 10 | -2 | 186 | 290.228 | 11 | ↓ |
| Mid Mid (pH 6-8) | -4.93 | -0.72 | -112.01 | 4 | 10 | -2 | 186 | 290.228 | 11 | ↓ |
| Mid Mid (pH 6-8) | -4.93 | -0.72 | -107.2 | 4 | 10 | -2 | 186 | 290.228 | 11 | ↓ |
| Mid Mid (pH 6-8) | -4.93 | -0.06 | -60.81 | 5 | 10 | -1 | 183 | 291.236 | 11 | ↓ |
| Mid Mid (pH 6-8) | -4.93 | 1.98 | -120.7 | 4 | 10 | -2 | 186 | 290.228 | 11 | ↓ |
| Lo Low (pH 4.5-6) | -4.93 | 1.09 | -54.22 | 6 | 10 | 0 | 188 | 292.244 | 11 | ↓ |
| Lo Low (pH 4.5-6) | -4.93 | 3.03 | -75.09 | 5 | 10 | -1 | 191 | 291.236 | 11 | ↓ |
