In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2010 | 20 | Yes |
Popular Name: (5-chloro-2-fluoro-phenyl)-[4-(cyclopropylmethyl)piperazin-1-yl]methanone (5-chloro-2-fluoro-phenyl)-[4-(c…
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) | 2.44 | 9.04 | -44.84 | 1 | 3 | 1 | 25 | 297.781 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.44 | 6.83 | -8.15 | 0 | 3 | 0 | 24 | 296.773 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.