In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 19 | Yes |
Popular Name: (4S)-4-methyl-N-(4-pyridyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide (4S)-4-methyl-N-(4-pyridyl)-6,7-…
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) | 2.23 | 6.53 | -9.7 | 1 | 4 | 0 | 45 | 273.361 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 6.98 | -37.29 | 2 | 4 | 1 | 46 | 274.369 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.