In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2009 | 24 | Yes |
Popular Name: 2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-5,6,7,8-tetrahydroquinoline 2-[4-[(4-chlorophenyl)methyl]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) | 4.53 | 10.8 | -26.57 | 1 | 3 | 1 | 21 | 342.894 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.53 | 12.75 | -43.01 | 1 | 3 | 1 | 21 | 342.894 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.53 | 10.52 | -5.42 | 0 | 3 | 0 | 19 | 341.886 | 3 | ↓ |