In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 24 | No |
Popular Name: (2R)-2-(8-methoxy-2H-chromene-3-carbonyl)-3-oxo-3-pyrrolidin-1-yl-propanenitrile (2R)-2-(8-methoxy-2H-chromene-3-…
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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) | 1.77 | 5.56 | -46.52 | 0 | 6 | -1 | 86 | 325.344 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.18 | 8.29 | -16.81 | 0 | 6 | 0 | 80 | 326.352 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.