In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2009 | 22 | Yes |
Popular Name: (2S)-N-(2,4-difluorophenyl)-2-(4-propylpiperazin-1-yl)propanamide (2S)-N-(2,4-difluorophenyl)-2-(4…
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) | 2.50 | 6.43 | -37.01 | 2 | 4 | 1 | 37 | 312.384 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.50 | 4.17 | -6.82 | 1 | 4 | 0 | 36 | 311.376 | 5 | ↓ |