In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 14 | Yes |
Popular Name: (1S)-N-(2-methoxyethyl)-N-methyl-1-[(3S)-tetrahydrofuran-3-yl]ethane-1,2-diamine (1S)-N-(2-methoxyethyl)-N-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) | -0.40 | -0.9 | -42.26 | 3 | 4 | 1 | 49 | 203.306 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.40 | -0.98 | -3.99 | 2 | 4 | 0 | 48 | 202.298 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.39 | 0.33 | -31.42 | 3 | 4 | 1 | 49 | 203.306 | 6 | ↓ |