In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2008 | 28 | Yes |
Popular Name: (1S)-1-(2,5-difluorophenyl)-2-(3-pyridylmethyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole (1S)-1-(2,5-difluorophenyl)-2-(3…
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) | 4.37 | 12.19 | -41.62 | 2 | 3 | 1 | 33 | 376.43 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.37 | 12.47 | -110.54 | 3 | 3 | 2 | 34 | 377.438 | 3 | ↓ |