In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2011 | 21 | No |
Popular Name: (2R)-3-[[(3R)-1,1-dioxothiolan-3-yl]-methyl-amino]-2-(methylamino)-2-phenyl-propan-1-ol (2R)-3-[[(3R)-1,1-dioxothiolan-3…
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) | 0.67 | -0.04 | -53.74 | 3 | 5 | 1 | 74 | 313.443 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.67 | -1.67 | -12.28 | 2 | 5 | 0 | 70 | 312.435 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.67 | 0.98 | -50.74 | 3 | 5 | 1 | 71 | 313.443 | 6 | ↓ |