In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 15 | Yes |
Popular Name: 4-[5-[(1R)-1-aminoethyl]thiazol-2-yl]piperazin-2-one 4-[5-[(1R)-1-aminoethyl]thiazol-…
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) | -1.33 | 0.31 | -49.29 | 4 | 5 | 1 | 73 | 227.313 | 2 | ↓ |
Mid Mid (pH 6-8) | -1.33 | -0.02 | -8.18 | 3 | 5 | 0 | 71 | 226.305 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.