In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2010 | 21 | Yes |
Popular Name: 1-(3-methylsulfanylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylic 1-(3-methylsulfanylphenyl)-5,6,7…
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) | 3.77 | 9.87 | -65.52 | 0 | 4 | -1 | 58 | 301.391 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.