In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2006 | 23 | Yes |
Popular Name: 4-(1,1-dimethylpropyl)-N-(6-ethyl-2-pyridyl)-benzenesulfonamide 4-(1,1-dimethylpropyl)-N-(6-ethy…
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) | 4.46 | 7.85 | -11.49 | 1 | 4 | 0 | 59 | 332.469 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.46 | 7.92 | -46.81 | 0 | 4 | -1 | 61 | 331.461 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.46 | 8.28 | -31.99 | 2 | 4 | 1 | 60 | 333.477 | 6 | ↓ |