In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2011 | 26 | Yes |
Popular Name: (8S)-2-morpholino-8-(2,4,5-trifluorophenyl)-4,5,7,8-tetrahydrothiazolo[4,5-c]azepin-6-one (8S)-2-morpholino-8-(2,4,5-trifl…
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) | 2.34 | 5.84 | -10.32 | 1 | 5 | 0 | 54 | 383.395 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.34 | 6.23 | -40.73 | 2 | 5 | 1 | 56 | 384.403 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.