In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 16 | Yes |
Popular Name: (1S)-1-(2-fluorophenyl)-N-methyl-1-(3-pyridyl)methanamine (1S)-1-(2-fluorophenyl)-N-methyl…
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) | 2.15 | 6.43 | -42.4 | 2 | 2 | 1 | 29 | 217.267 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.15 | 5.48 | -4.61 | 1 | 2 | 0 | 25 | 216.259 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.