In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 27 | Yes |
Popular Name: fluoro-(fluoromethyl)-keto-(4-methylpiperazin-4-ium-1-yl)BLAHcarboxylate fluoro-(fluoromethyl)-keto-(4-me…
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) | -0.34 | 10.15 | -102.05 | 1 | 7 | 0 | 79 | 379.363 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.34 | 7.8 | -66.76 | 0 | 7 | -1 | 78 | 378.355 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.34 | 8.14 | -57.57 | 2 | 7 | 1 | 76 | 380.371 | 3 | ↓ |
Lo Low (pH 4.5-6) | -3.08 | 8.28 | -79.33 | 2 | 7 | 1 | 82 | 380.371 | 2 | ↓ |