In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2011 | 24 | Yes |
Popular Name: (8R)-8-(2,5-dichlorophenyl)-2-pyrrolidin-1-yl-4,5,7,8-tetrahydrothiazolo[4,5-c]azepin-6-one (8R)-8-(2,5-dichlorophenyl)-2-py…
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) | 3.84 | 8.28 | -9.35 | 1 | 4 | 0 | 45 | 382.316 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.84 | 8.69 | -33.83 | 2 | 4 | 1 | 46 | 383.324 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.