In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 18 | Yes |
Popular Name: 4-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylamino)pyridine-2-carboxylic 4-(5,6-dihydro-4H-cyclopenta[d]t…
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) | 2.69 | 6.92 | -30.51 | 2 | 5 | 0 | 79 | 261.306 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.69 | 6.51 | -52.56 | 1 | 5 | -1 | 78 | 260.298 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.