In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2010 | 21 | Yes |
Popular Name: 2-chloro-N-[4-(4-methylpiperazin-1-yl)butyl]benzamide 2-chloro-N-[4-(4-methylpiperazin…
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) | 2.22 | 6.41 | -41.55 | 2 | 4 | 1 | 37 | 310.849 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.22 | 6.29 | -44.45 | 2 | 4 | 1 | 37 | 310.849 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.22 | 4.03 | -10.88 | 1 | 4 | 0 | 36 | 309.841 | 6 | ↓ |