In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2011 | 20 | Yes |
Popular Name: (2S)-6-[[(1R)-1-cyclopropylethyl]-(2-methoxyethyl)amino]-2-methyl-2-(methylamino)hexan-1-ol (2S)-6-[[(1R)-1-cyclopropylethyl…
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) | 2.16 | 4.68 | -79.46 | 4 | 4 | 2 | 51 | 288.476 | 12 | ↓ |
Hi High (pH 8-9.5) | 2.16 | 2.81 | -33.67 | 3 | 4 | 1 | 49 | 287.468 | 12 | ↓ |
Hi High (pH 8-9.5) | 2.16 | 3.57 | -33.54 | 3 | 4 | 1 | 46 | 287.468 | 12 | ↓ |