In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 20 | Yes |
Popular Name: [2-[4-(4-chlorophenyl)piperazin-1-yl]thiazol-5-yl]methanamine [2-[4-(4-chlorophenyl)piperazin-…
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) | 2.78 | 6.17 | -48.12 | 3 | 4 | 1 | 47 | 309.846 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.78 | 5.77 | -6.74 | 2 | 4 | 0 | 45 | 308.838 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.