In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 24 | Yes |
Popular Name: N-methyl-N-(1-quinazolin-4-yl-4-piperidyl)pent-4-enamide N-methyl-N-(1-quinazolin-4-yl-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) | 2.93 | 10.64 | -10.46 | 0 | 5 | 0 | 49 | 324.428 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.93 | 11.11 | -34.89 | 1 | 5 | 1 | 51 | 325.436 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.93 | 11.11 | -35.7 | 1 | 5 | 1 | 51 | 325.436 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.