In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 16 | Yes |
Popular Name: 2-[cyclopropyl(methyl)amino]-1-(5-fluoro-2-hydroxy-phenyl)ethanone 2-[cyclopropyl(methyl)amino]-1-(…
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) | 1.94 | 6.38 | -36.73 | 2 | 3 | 1 | 42 | 224.255 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.94 | 4.98 | -45.42 | 0 | 3 | -1 | 43 | 222.239 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.94 | 3.98 | -7.15 | 1 | 3 | 0 | 41 | 223.247 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.94 | 7.38 | -47.42 | 1 | 3 | 0 | 45 | 223.247 | 4 | ↓ |