In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2008 | 21 | Yes |
Popular Name: (2S)-N-(2-chloro-4-fluoro-phenyl)-2-(4-ethylpiperazin-1-yl)propanamide (2S)-N-(2-chloro-4-fluoro-phenyl…
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) | 2.51 | 6.18 | -36.09 | 2 | 4 | 1 | 37 | 314.812 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.51 | 3.89 | -5.53 | 1 | 4 | 0 | 36 | 313.804 | 4 | ↓ |