In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 18 | Yes |
Popular Name: (1S)-2-(2,6-dichlorophenyl)-N-methyl-1-(3-pyridyl)ethanamine (1S)-2-(2,6-dichlorophenyl)-N-me…
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) | 3.51 | 7.36 | -38.74 | 2 | 2 | 1 | 29 | 282.194 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.51 | 6.77 | -4.71 | 1 | 2 | 0 | 25 | 281.186 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.51 | 7.88 | -95.42 | 3 | 2 | 2 | 31 | 283.202 | 4 | ↓ |