| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 16 | Yes |
Popular Name: (1S,2S,4R)-N2-(1-ethylpropyl)-N1,N2,4-trimethyl-cyclohexane-1,2-diamine (1S,2S,4R)-N2-(1-ethylpropyl)-N1…
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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) | 3.27 | 7.49 | -109.8 | 3 | 2 | 2 | 21 | 228.424 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.27 | 6.19 | -29.8 | 2 | 2 | 1 | 16 | 227.416 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.27 | 5.5 | -33.88 | 2 | 2 | 1 | 20 | 227.416 | 5 | ↓ |
