In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2009 | 23 | No |
Popular Name: (9aR)-2-(4-methyl-3-nitro-phenyl)sulfonyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine (9aR)-2-(4-methyl-3-nitro-phenyl…
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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) | 2.37 | 7.3 | -47.88 | 1 | 7 | 1 | 88 | 340.425 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.37 | 5.04 | -10.82 | 0 | 7 | 0 | 86 | 339.417 | 3 | ↓ |