In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2009 | 15 | No |
Popular Name: (2R)-1-(dimethylamino)-3-[[(3S)-1,1-dioxothiolan-3-yl]amino]propan-2-ol (2R)-1-(dimethylamino)-3-[[(3S)-…
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) | -1.00 | -1.02 | -126.8 | 4 | 5 | 2 | 75 | 238.353 | 5 | ↓ |
Mid Mid (pH 6-8) | -1.00 | -0.45 | -59.93 | 3 | 5 | 1 | 78 | 237.345 | 5 | ↓ |
Mid Mid (pH 6-8) | -1.00 | -2.16 | -48.25 | 3 | 5 | 1 | 71 | 237.345 | 5 | ↓ |