In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 17 | Yes |
Popular Name: 3-amino-N-[(1S,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]thiophene-2-carboxamide 3-amino-N-[(1S,8R)-2,3,5,6,7,8-h…
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) | 0.98 | 3.31 | -38.07 | 4 | 4 | 1 | 60 | 252.363 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.98 | 3.14 | -82.93 | 5 | 4 | 2 | 61 | 253.371 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.