In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2011 | 20 | Yes |
Popular Name: [4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]-thiazol-4-yl-methanone [4-[(5-chloro-2-thienyl)methyl]p…
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) | 2.54 | 5.22 | -10.08 | 0 | 4 | 0 | 36 | 327.862 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.54 | 7.44 | -44.65 | 1 | 4 | 1 | 38 | 328.87 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.