In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 17 | Yes |
Popular Name: 2-[(4aS,7aR)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl]thiazole-5-carboxylic 2-[(4aS,7aR)-3,4a,5,6,7,7a-hexah…
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) | 1.63 | 5.7 | -49.44 | 0 | 5 | -1 | 65 | 253.303 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.63 | 6.14 | -38.95 | 1 | 5 | 0 | 67 | 254.311 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.