| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 9 | Yes |
Popular Name: 1,2-Cyclohexanediamine, 3-methyl-, [1S-(1alpha,2alpha,3alpha)]- (9CI) 1,2-Cyclohexanediamine, 3-methyl…
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CAS Number: 755711-20-7
| 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) | -0.31 | 0.41 | -122.27 | 6 | 2 | 2 | 55 | 130.235 | 0 | ↓ |
| Hi High (pH 8-9.5) | -0.31 | 0.54 | -39.71 | 5 | 2 | 1 | 54 | 129.227 | 0 | ↓ |
| Hi High (pH 8-9.5) | -0.31 | 0.13 | -39.94 | 5 | 2 | 1 | 54 | 129.227 | 0 | ↓ |
