In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 22 | Yes |
Popular Name: 2-chloro-6-fluoro-N-[4-(4-methylpiperazin-1-yl)butyl]benzamide 2-chloro-6-fluoro-N-[4-(4-methyl…
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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) | 2.34 | 6.23 | -40.69 | 2 | 4 | 1 | 37 | 328.839 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.34 | 6.12 | -42.5 | 2 | 4 | 1 | 37 | 328.839 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.34 | 3.86 | -10.7 | 1 | 4 | 0 | 36 | 327.831 | 6 | ↓ |