| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 44 | No |
Popular Name: 4-[methyl-phenyl-(p-phenetidino)BLAHyl]benzoic-acid-methyl-ester 4-[methyl-phenyl-(p-phenetidino)…
| 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) | 7.79 | 18.95 | -18.08 | 1 | 9 | 0 | 96 | 582.664 | 8 | ↓ |
| Hi High (pH 8-9.5) | 7.79 | 18.33 | -53.45 | 0 | 9 | -1 | 98 | 581.656 | 8 | ↓ |
| Mid Mid (pH 6-8) | 7.79 | 19.38 | -36.18 | 2 | 9 | 1 | 97 | 583.672 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
