In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 20 | Yes |
Popular Name: 2-(ethylamino)-2-methyl-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propan-1-one 2-(ethylamino)-2-methyl-1-(4-phe…
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) | 2.62 | 7.88 | -36.97 | 2 | 3 | 1 | 37 | 273.4 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.62 | 7.97 | -6.08 | 1 | 3 | 0 | 32 | 272.392 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.