In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2011 | 23 | No |
Popular Name: N'-[4-(cyanomethyl)phenyl]-N-[(3-fluorophenyl)methyl]oxamide N'-[4-(cyanomethyl)phenyl]-N-[(3…
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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) | 1.73 | 6.12 | -13.44 | 2 | 5 | 0 | 82 | 311.316 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.