In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 6th, 2009 | 18 | Yes |
Popular Name: (3S,4aR,6S,8aR)-6-(2-carboxyethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic (3S,4aR,6S,8aR)-6-(2-carboxyethy…
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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) | -0.24 | 5.06 | -84.32 | 2 | 5 | -1 | 97 | 254.306 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.24 | 3.94 | -46.21 | 3 | 5 | 0 | 94 | 255.314 | 4 | ↓ |