In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 20 | Yes |
Popular Name: (2S)-2-[2-methoxyethyl-[(1R)-2-methoxy-1-methyl-ethyl]amino]-1-piperazin-1-yl-propan-1-one (2S)-2-[2-methoxyethyl-[(1R)-2-m…
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) | -0.38 | 2.28 | -29.5 | 2 | 6 | 1 | 55 | 288.412 | 8 | ↓ |
Hi High (pH 8-9.5) | -0.38 | -0.33 | -11.89 | 1 | 6 | 0 | 54 | 287.404 | 8 | ↓ |
Mid Mid (pH 6-8) | -0.38 | 3.78 | -88.42 | 3 | 6 | 2 | 60 | 289.42 | 8 | ↓ |
Mid Mid (pH 6-8) | -0.38 | 1 | -52.64 | 2 | 6 | 1 | 59 | 288.412 | 8 | ↓ |