In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 28 | Yes |
Popular Name: 5-(2-imidazol-1-ylethyl)-3-(4-phenylphenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine 5-(2-imidazol-1-ylethyl)-3-(4-ph…
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) | 3.48 | 11.57 | -40.92 | 2 | 5 | 1 | 51 | 370.48 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.48 | 11.06 | -11.59 | 1 | 5 | 0 | 50 | 369.472 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.48 | 13.26 | -55.6 | 2 | 5 | 1 | 51 | 370.48 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.48 | 13.77 | -114.1 | 3 | 5 | 2 | 52 | 371.488 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.