In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 19 | Yes |
Popular Name: 3-[[(2S)-2-methylindolin-1-yl]methyl]-5-propyl-1,2,4-oxadiazole 3-[[(2S)-2-methylindolin-1-yl]me…
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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) | 2.92 | 7.1 | -6.97 | 0 | 4 | 0 | 42 | 257.337 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.92 | 7.22 | -30.42 | 1 | 4 | 1 | 43 | 258.345 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.