In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2011 | 25 | Yes |
Popular Name: (2S)-N-thiazol-2-yl-2-[4-[3-(2,2,2-trifluoroethoxy)propyl]piperazin-1-yl]propanamide (2S)-N-thiazol-2-yl-2-[4-[3-(2,2…
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) | 1.60 | 5.23 | -49.26 | 2 | 6 | 1 | 59 | 381.444 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.60 | 2.97 | -16.61 | 1 | 6 | 0 | 58 | 380.436 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.