In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 20 | Yes |
Popular Name: (2S,2'S)-2,2'-(Ethane-1,2-diylbis(azanediyl))disuccinic acid (2S,2'S)-2,2'-(Ethane-1,2-diylbi…
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CAS Numbers: 178949-82-1 , 20846-91-7
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) | -4.93 | 0.32 | -175.49 | 3 | 10 | -3 | 189 | 289.22 | 11 | ↓ |
Mid Mid (pH 6-8) | -4.93 | -0.8 | -108.1 | 4 | 10 | -2 | 186 | 290.228 | 11 | ↓ |
Mid Mid (pH 6-8) | -4.93 | -0.81 | -109.82 | 4 | 10 | -2 | 186 | 290.228 | 11 | ↓ |
Lo Low (pH 4.5-6) | -4.93 | 0.38 | -88 | 5 | 10 | -1 | 191 | 291.236 | 11 | ↓ |