In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 25 | Yes |
Popular Name: [1-(2-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazol-5-yl]-(4-methylpiperazin-1-yl)methanone [1-(2-chlorophenyl)-3-methyl-thi…
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) | 3.36 | 7.61 | -12.29 | 0 | 5 | 0 | 41 | 374.897 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.36 | 9.98 | -53.1 | 1 | 5 | 1 | 43 | 375.905 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.