In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 19 | Yes |
Popular Name: 6-amino-N-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyridine-2-carboxamide 6-amino-N-[(4R)-4,5,6,7-tetrahyd…
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) | 0.87 | 4.61 | -9.54 | 3 | 4 | 0 | 68 | 273.361 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.87 | 5.11 | -35.72 | 4 | 4 | 1 | 69 | 274.369 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.