In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 21 | Yes |
Popular Name: 2-chloro-4-[[[(1S)-1-(2-methoxyphenyl)propyl]amino]methyl]phenol 2-chloro-4-[[[(1S)-1-(2-methoxyp…
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) | 3.45 | 6.62 | -42.09 | 3 | 3 | 1 | 46 | 306.813 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.45 | 7.39 | -53.24 | 2 | 3 | 0 | 49 | 305.805 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.45 | 6.67 | -42.46 | 1 | 3 | -1 | 44 | 304.797 | 6 | ↓ |