In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 21 | Yes |
Popular Name: (1R)-1-[2-[4-(2-fluorophenyl)piperazin-1-yl]thiazol-5-yl]ethanamine (1R)-1-[2-[4-(2-fluorophenyl)pip…
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) | 0.90 | 6.83 | -45.36 | 3 | 4 | 1 | 47 | 307.418 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.90 | 6.5 | -6.52 | 2 | 4 | 0 | 45 | 306.41 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.