In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 22 | No |
Popular Name: N-isobutyl-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]cyclopropanamine N-isobutyl-N-[(6-nitro-4H-1,3-be…
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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) | 2.90 | 9.8 | -37.91 | 1 | 6 | 1 | 69 | 307.37 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.90 | 7.69 | -6.32 | 0 | 6 | 0 | 68 | 306.362 | 6 | ↓ |