In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 14 | Yes |
Popular Name: (1R,2S)-N1-ethyl-N1-(2-methoxyethyl)-N2-methyl-cyclopentane-1,2-diamine (1R,2S)-N1-ethyl-N1-(2-methoxyet…
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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) | 1.37 | 6.42 | -96.52 | 3 | 3 | 2 | 30 | 202.342 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.37 | 3.75 | -1.12 | 1 | 3 | 0 | 24 | 200.326 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.37 | 4.02 | -27.66 | 2 | 3 | 1 | 29 | 201.334 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.37 | 5.19 | -26.65 | 2 | 3 | 1 | 26 | 201.334 | 6 | ↓ |