In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2010 | 18 | Yes |
Popular Name: N-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-N-isobutyl-2-methyl-propan-1-amine N-[(5-cyclopropyl-1,2,4-oxadiazo…
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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) | 2.43 | 7.73 | -32.91 | 1 | 4 | 1 | 43 | 252.382 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.43 | 5.92 | -5.27 | 0 | 4 | 0 | 42 | 251.374 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.