| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2011 | 26 | Yes |
Popular Name: 2-(dimethylamino)-N-[3-[4-(methanesulfonamido)phenyl]propyl]pyridine-3-carboxamide 2-(dimethylamino)-N-[3-[4-(metha…
| 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) | 1.84 | 5.37 | -48.41 | 1 | 7 | -1 | 93 | 375.474 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 5.21 | -19.77 | 2 | 7 | 0 | 91 | 376.482 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.84 | 5.68 | -46.84 | 3 | 7 | 1 | 93 | 377.49 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
