| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 17 | Yes |
Popular Name: [(1S,3R)-1-(4-aminoanilino)-3-methyl-cyclohexyl]methanol [(1S,3R)-1-(4-aminoanilino)-3-me…
| 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) | 2.22 | 2.43 | -3.65 | 4 | 3 | 0 | 58 | 234.343 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.22 | 2.28 | -15.36 | 5 | 3 | 0 | 63 | 235.351 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.22 | 2.29 | -41.01 | 5 | 3 | 1 | 60 | 235.351 | 3 | ↓ |
