| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2011 | 22 | Yes |
Popular Name: (1S)-2-[(5-chloro-3-isopropyl-1-methyl-pyrazol-4-yl)methylamino]-1-(4-fluorophenyl)ethanol (1S)-2-[(5-chloro-3-isopropyl-1-…
| 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 | 4.51 | -7.61 | 2 | 4 | 0 | 50 | 325.815 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.93 | 5.93 | -49.6 | 3 | 4 | 1 | 55 | 326.823 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
