In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2004 | 24 | Yes |
Popular Name: 4-bromo-N-[4-(4-pyridinylmethyl)phenyl]benzenesulfonamide 4-bromo-N-[4-(4-pyridinylmethyl)…
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) | 4.18 | 7.72 | -11.18 | 1 | 4 | 0 | 59 | 403.301 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.18 | 7.76 | -44.05 | 0 | 4 | -1 | 61 | 402.293 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.18 | 8.18 | -40.9 | 2 | 4 | 1 | 60 | 404.309 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.