In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 19 | No |
Popular Name: 2-[(2R)-3-amino-2-hydroxy-propyl]-4-nitro-isoindoline-1,3-dione 2-[(2R)-3-amino-2-hydroxy-propyl…
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) | -0.72 | 1.42 | -59.79 | 4 | 8 | 1 | 133 | 266.233 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.72 | 1.04 | -17.86 | 3 | 8 | 0 | 131 | 265.225 | 4 | ↓ |