In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2011 | 18 | Yes |
Popular Name: 5-[[(3R)-3-propylpyrrolidin-3-yl]methyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine 5-[[(3R)-3-propylpyrrolidin-3-yl…
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) | 3.03 | 6.65 | -42.94 | 2 | 2 | 1 | 20 | 265.446 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.03 | 8.19 | -110.21 | 3 | 2 | 2 | 21 | 266.454 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.