In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2011 | 20 | No |
Popular Name: (8R)-2-amino-8-(2-methoxy-3-pyridyl)-4,5,7,8-tetrahydrothiazolo[4,5-c]azepin-6-one (8R)-2-amino-8-(2-methoxy-3-pyri…
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) | 0.64 | 0.19 | -12.38 | 3 | 6 | 0 | 90 | 290.348 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.64 | 0.61 | -42.23 | 4 | 6 | 1 | 91 | 291.356 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.