In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 26 | Yes |
Popular Name: N-[2-[4-(7-chloro-4-quinolyl)piperazin-1-yl]ethyl]pentanamide N-[2-[4-(7-chloro-4-quinolyl)pip…
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) | 3.87 | 7.92 | -38.75 | 2 | 5 | 1 | 50 | 375.924 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.87 | 7.48 | -10.75 | 1 | 5 | 0 | 48 | 374.916 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.87 | 10.13 | -101.86 | 3 | 5 | 2 | 51 | 376.932 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.87 | 9.71 | -54.57 | 2 | 5 | 1 | 50 | 375.924 | 7 | ↓ |