In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2008 | 21 | No |
Popular Name: (7R)-2-amino-7-(4-prop-2-ynoxyphenyl)-6,7-dihydro-4H-thiazolo[5,4-e]pyridin-5-one (7R)-2-amino-7-(4-prop-2-ynoxyph…
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) | 1.93 | 5.09 | -13.13 | 3 | 5 | 0 | 77 | 299.355 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.93 | 5.32 | -41.01 | 4 | 5 | 1 | 78 | 300.363 | 3 | ↓ |