In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 25th, 2009 | 21 | Yes |
Popular Name: 4-(2-aminoethyl)-2,5-diphenyl-1,2-dihydro-3H-pyrazol-3-one 4-(2-aminoethyl)-2,5-diphenyl-1,…
None
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) | 2.15 | 5.39 | -55.5 | 3 | 4 | 0 | 69 | 279.343 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.69 | 6.17 | -11.9 | 3 | 4 | 0 | 64 | 279.343 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.15 | 4.64 | -49.66 | 4 | 4 | 1 | 66 | 280.351 | 4 | ↓ |