In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 20 | Yes |
Popular Name: 2-[[[4-(1,1-dimethylpropyl)cyclohexyl]amino]methyl]phenol 2-[[[4-(1,1-dimethylpropyl)cyclo…
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) | 4.78 | 7.57 | -36.25 | 3 | 2 | 1 | 37 | 276.444 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.78 | 8.33 | -32.42 | 2 | 2 | 0 | 40 | 275.436 | 5 | ↓ |