In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2010 | 21 | Yes |
Popular Name: (1R,3S)-1-[[(4-methoxyphenyl)methylamino]methyl]-N,N,3-trimethyl-cyclohexanamine (1R,3S)-1-[[(4-methoxyphenyl)met…
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) | 3.57 | 9.17 | -122.25 | 3 | 3 | 2 | 30 | 292.467 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 7.84 | -33.22 | 2 | 3 | 1 | 26 | 291.459 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.57 | 7.06 | -41.22 | 2 | 3 | 1 | 29 | 291.459 | 6 | ↓ |