In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 20 | Yes |
Popular Name: (1S,5S)-1-(3-chloroanilino)-3,3,5-trimethyl-cyclohexanecarboxylic (1S,5S)-1-(3-chloroanilino)-3,3,…
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) | 2.35 | 9.42 | -44.86 | 1 | 3 | -1 | 52 | 294.802 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.35 | 7.6 | -4.79 | 2 | 3 | 0 | 49 | 295.81 | 3 | ↓ |