In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 20 | Yes |
Popular Name: N-[(1S)-2-(3-bromophenyl)-1-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine N-[(1S)-2-(3-bromophenyl)-1-(1-e…
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) | 3.90 | 9.39 | -44.01 | 2 | 3 | 1 | 34 | 337.285 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.90 | 8.49 | -6.03 | 1 | 3 | 0 | 30 | 336.277 | 7 | ↓ |