In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 19 | Yes |
Popular Name: (1R)-N-(2-methoxyethyl)-N-[(1S)-2-methoxy-1-methyl-ethyl]-1-(3-pyridyl)ethane-1,2-diamine (1R)-N-(2-methoxyethyl)-N-[(1S)-…
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) | -0.21 | 1.03 | -40.93 | 3 | 5 | 1 | 62 | 268.381 | 9 | ↓ |
Hi High (pH 8-9.5) | -0.21 | -0.13 | -3.35 | 2 | 5 | 0 | 61 | 267.373 | 9 | ↓ |
Lo Low (pH 4.5-6) | -0.21 | 3.81 | -121.49 | 4 | 5 | 2 | 63 | 269.389 | 9 | ↓ |