In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | Yes |
Popular Name: (2S)-1-[(4-methylcyclohexyl)amino]-3-(2-methylphenoxy)propan-2-ol (2S)-1-[(4-methylcyclohexyl)amin…
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) | 3.21 | 6.13 | -43.48 | 3 | 3 | 1 | 46 | 278.416 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.21 | 4.9 | -4.89 | 2 | 3 | 0 | 41 | 277.408 | 6 | ↓ |