In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2010 | 23 | Yes |
Popular Name: 2-(isopropylamino)-N-[(1S,2S,3S,5R)-2,6,6-trimethylnorpinan-3-yl]pyridine-3-carboxamide 2-(isopropylamino)-N-[(1S,2S,3S,…
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) | 3.61 | 8.33 | -7.73 | 2 | 4 | 0 | 54 | 315.461 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.61 | 8.65 | -33.32 | 3 | 4 | 1 | 55 | 316.469 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.