In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2010 | 19 | Yes |
Popular Name: (2R)-N1-isobutyl-N2-(2-methoxyethyl)-N2-[(1S)-2-methoxy-1-methyl-ethyl]butane-1,2-diamine (2R)-N1-isobutyl-N2-(2-methoxyet…
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) | 2.06 | 5.08 | -36.86 | 2 | 4 | 1 | 38 | 275.457 | 12 | ↓ |
Hi High (pH 8-9.5) | 2.06 | 5.09 | -1.49 | 1 | 4 | 0 | 34 | 274.449 | 12 | ↓ |
Lo Low (pH 4.5-6) | 2.06 | 6.16 | -101.42 | 3 | 4 | 2 | 40 | 276.465 | 12 | ↓ |