In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2011 | 22 | No |
Popular Name: (8R)-2-amino-8-(8-quinolyl)-4,5,7,8-tetrahydrothiazolo[4,5-c]azepin-6-one (8R)-2-amino-8-(8-quinolyl)-4,5,…
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) | 1.49 | 3.97 | -13.82 | 3 | 5 | 0 | 81 | 310.382 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.49 | 4.39 | -41.18 | 4 | 5 | 1 | 82 | 311.39 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.