In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 17 | Yes |
Popular Name: 2-chloro-4-[[[(1R,3R)-3-methylcyclohexyl]amino]methyl]phenol 2-chloro-4-[[[(1R,3R)-3-methylcy…
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) | 3.80 | 5.72 | -44.53 | 3 | 2 | 1 | 37 | 254.781 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.80 | 6.49 | -57.32 | 2 | 2 | 0 | 40 | 253.773 | 3 | ↓ |