In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 13 | Yes |
Popular Name: (2S)-N2-[(1S)-2-methoxy-1-methyl-ethyl]-N1,N2-dimethyl-butane-1,2-diamine (2S)-N2-[(1S)-2-methoxy-1-methyl…
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) | 1.31 | 2.85 | -38.19 | 2 | 3 | 1 | 29 | 189.323 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.31 | 3.24 | -27.36 | 2 | 3 | 1 | 26 | 189.323 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.31 | 1.83 | -1.62 | 1 | 3 | 0 | 24 | 188.315 | 7 | ↓ |