In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 29 | Yes |
Popular Name: 1-[4-[2-(3-bromophenyl)quinazolin-4-yl]piperazin-1-yl]-3-methyl-butan-1-one 1-[4-[2-(3-bromophenyl)quinazoli…
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) | 5.53 | 13.32 | -12.23 | 0 | 5 | 0 | 49 | 453.384 | 4 | ↓ |
Lo Low (pH 4.5-6) | 5.53 | 13.66 | -34.66 | 1 | 5 | 1 | 51 | 454.392 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.