In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 20 | Yes |
Popular Name: N-(5-amino-2-fluoro-phenyl)-3-(4-methylpiperazin-1-yl)propanamide N-(5-amino-2-fluoro-phenyl)-3-(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) | 0.48 | 2.96 | -42.04 | 4 | 5 | 1 | 63 | 281.355 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.48 | 2.83 | -44.16 | 4 | 5 | 1 | 63 | 281.355 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.48 | 0.49 | -9.66 | 3 | 5 | 0 | 62 | 280.347 | 4 | ↓ |