In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2009 | 22 | Yes |
Popular Name: (2S)-2-[[(1S,4R,5S,6R)-5-carboxybicyclo[2.2.1]hept-2-ene-6-carbonyl]amino]pentanedioic (2S)-2-[[(1S,4R,5S,6R)-5-carboxy…
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) | -1.78 | 6.87 | -202.14 | 1 | 8 | -3 | 149 | 308.266 | 7 | ↓ |
Lo Low (pH 4.5-6) | -1.78 | 3.29 | -120.99 | 2 | 8 | -2 | 147 | 309.274 | 7 | ↓ |