In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 36 | Yes |
Popular Name: 7-chloro-4-[4-[2-[4-(7-chloro-4-quinolyl)piperazin-1-yl]ethyl]piperazin-1-yl]quinoline 7-chloro-4-[4-[2-[4-(7-chloro-4-…
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) | 5.33 | 9.42 | -74.88 | 2 | 6 | 2 | 41 | 523.512 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.33 | 9.01 | -38.43 | 1 | 6 | 1 | 40 | 522.504 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.33 | 11.79 | -154.09 | 3 | 6 | 3 | 42 | 524.52 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.33 | 11.39 | -98.25 | 2 | 6 | 2 | 41 | 523.512 | 5 | ↓ |