In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 31st, 2010 | 31 | Yes |
Popular Name: 5-chloro-2-methoxy-N-[4-[[4-(2-pyridyl)piperazin-1-yl]methyl]phenyl]benzamide 5-chloro-2-methoxy-N-[4-[[4-(2-p…
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) | 4.53 | 10.87 | -34.63 | 2 | 6 | 1 | 59 | 437.951 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.53 | 10.53 | -12.82 | 1 | 6 | 0 | 58 | 436.943 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.53 | 13.09 | -98.69 | 3 | 6 | 2 | 60 | 438.959 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.53 | 12.75 | -46.25 | 2 | 6 | 1 | 59 | 437.951 | 6 | ↓ |