In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2010 | 18 | Yes |
Popular Name: (1S)-1-pyrazin-2-yl-2-(2,4,6-trimethylphenyl)ethanamine (1S)-1-pyrazin-2-yl-2-(2,4,6-tri…
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) | 0.96 | 5.41 | -45.66 | 3 | 3 | 1 | 53 | 242.346 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.96 | 5.18 | -5.24 | 2 | 3 | 0 | 52 | 241.338 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.