In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2008 | 28 | No |
Popular Name: 2-[(5S)-1-(benzenesulfonyl)-5-(o-tolyl)-4,5-dihydropyrazol-3-yl]phenol 2-[(5S)-1-(benzenesulfonyl)-5-(o…
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) | 4.81 | 7.89 | -20.09 | 1 | 5 | 0 | 70 | 392.48 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.81 | 8.68 | -64.04 | 0 | 5 | -1 | 73 | 391.472 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.