In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2010 | 22 | Yes |
Popular Name: 3,5-dimethyl-N-[4-(4-methylpiperazin-1-yl)butyl]benzamide 3,5-dimethyl-N-[4-(4-methylpiper…
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) | 2.42 | 7.22 | -40.15 | 2 | 4 | 1 | 37 | 304.458 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.42 | 4.85 | -9.34 | 1 | 4 | 0 | 36 | 303.45 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.42 | 7.11 | -43 | 2 | 4 | 1 | 37 | 304.458 | 6 | ↓ |