In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 19 | Yes |
Popular Name: 1-(tert-butyl)-6-(4-chlorophenyl)dihydro-2,4(1H,3H)-pyridinedione 1-(tert-butyl)-6-(4-chlorophenyl…
Find On: PubMed — Wikipedia — Google
CAS Number: 400079-95-0
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) | 2.68 | 1.29 | -7.68 | 0 | 3 | 0 | 37 | 279.767 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 151 - 153 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.