In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 22 | Yes |
Popular Name: methyl N-[2-(4-chlorophenyl)-4-quinolinyl]carbamate methyl N-[2-(4-chlorophenyl)-4-q…
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CAS Number: 861208-66-4
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) | 4.45 | -0.29 | -9.06 | 1 | 4 | 0 | 51 | 312.756 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.45 | -0.16 | -28.65 | 2 | 4 | 1 | 52 | 313.764 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 201 - 203 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.