In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 23rd, 2009 | 14 | Yes |
Popular Name: N-[(1S)-2-(2-furyl)-1-methyl-ethyl]-N',N'-dimethyl-ethane-1,2-diamine N-[(1S)-2-(2-furyl)-1-methyl-eth…
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) | 1.52 | 6.01 | -103.84 | 3 | 3 | 2 | 34 | 198.31 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.52 | 2.41 | -3.39 | 1 | 3 | 0 | 28 | 196.294 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.52 | 4.85 | -32.85 | 2 | 3 | 1 | 30 | 197.302 | 6 | ↓ |