In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 20 | Yes |
Popular Name: 4-[5-[(1S)-1-aminoethyl]-4-methyl-thiazol-2-yl]-1,3-dihydroquinoxalin-2-one 4-[5-[(1S)-1-aminoethyl]-4-methy…
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) | 0.48 | 4.19 | -49.83 | 4 | 5 | 1 | 73 | 289.384 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.48 | 3.85 | -8.9 | 3 | 5 | 0 | 71 | 288.376 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.