| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2004 | 19 | No |
Popular Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-pyrrole-2-carbothioamide 1-[3-chloro-5-(trifluoromethyl)-…
Find On: PubMed — Wikipedia — Google
CAS Number: 400080-85-5
| 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) | 3.26 | 0.32 | -13.23 | 2 | 3 | 0 | 43 | 305.712 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 122 - 124 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.
