| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2009 | 17 | Yes |
Popular Name: 4-(2-aminoethyl)-5-ethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one 4-(2-aminoethyl)-5-ethyl-2-pheny…
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CAS Number: 952959-53-4
| 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) | 1.27 | 2.4 | -51.54 | 4 | 4 | 1 | 66 | 232.307 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.81 | 4.05 | -13.45 | 3 | 4 | 0 | 64 | 231.299 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.46 | 4.26 | -11.18 | 2 | 4 | 0 | 59 | 231.299 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.46 | 4.27 | -9.63 | 2 | 4 | 0 | 59 | 231.299 | 4 | ↓ |
