In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 30 | Yes |
Popular Name: 4-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-phenyl-quinazoline 4-[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) | 5.85 | 13.76 | -26.23 | 1 | 4 | 1 | 34 | 415.948 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.85 | 13.75 | -25.65 | 1 | 4 | 1 | 34 | 415.948 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.85 | 13.42 | -9.4 | 0 | 4 | 0 | 32 | 414.94 | 4 | ↓ |
Lo Low (pH 4.5-6) | 5.85 | 15.97 | -89.43 | 2 | 4 | 2 | 35 | 416.956 | 4 | ↓ |