In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 23 | Yes |
Popular Name: N-isobutyl-N-[[(2S)-morpholin-2-yl]methyl]-1,3-benzodioxole-5-carboxamide N-isobutyl-N-[[(2S)-morpholin-2-…
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) | 1.18 | 4.97 | -60.09 | 2 | 6 | 1 | 65 | 321.397 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.18 | 3.6 | -10.2 | 1 | 6 | 0 | 60 | 320.389 | 5 | ↓ |