In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 20 | No |
Popular Name: (4R)-N-[(3S)-1-ethyl-3-piperidyl]-4-phenyl-4,5-dihydrothiazol-2-amine (4R)-N-[(3S)-1-ethyl-3-piperidyl…
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) | 2.77 | 9.43 | -87.82 | 3 | 3 | 2 | 30 | 291.464 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 7.2 | -26.92 | 2 | 3 | 1 | 29 | 290.456 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.