In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 25th, 2008 | 29 | Yes |
Popular Name: N-[(2S)-2-dimethylamino-2-(3-fluorophenyl)ethyl]-5-ethyl-1-(p-tolyl)pyrazole-4-carboxamide N-[(2S)-2-dimethylamino-2-(3-flu…
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) | 3.78 | 11.5 | -54.21 | 2 | 5 | 1 | 51 | 395.502 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.78 | 9.25 | -11.7 | 1 | 5 | 0 | 50 | 394.494 | 7 | ↓ |