In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 29 | No |
Popular Name: 2-[[(2R)-2-[2-(3,4-diethoxyphenyl)acetyl]-5,5-dimethyl-3-oxo-cyclohexylidene]amino]acetic 2-[[(2R)-2-[2-(3,4-diethoxypheny…
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) | 1.06 | 9.04 | -56.8 | 0 | 7 | -1 | 105 | 402.467 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.64 | 8.14 | -127.68 | 0 | 7 | -2 | 111 | 401.459 | 8 | ↓ |