In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2010 | 19 | Yes |
Popular Name: (1S,6S)-6-[(4-bromo-2-thienyl)methylcarbamoyl]cyclohex-3-ene-1-carboxylic (1S,6S)-6-[(4-bromo-2-thienyl)me…
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) | 2.36 | 6.9 | -54.49 | 1 | 4 | -1 | 69 | 343.222 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.36 | 5.84 | -9.87 | 2 | 4 | 0 | 66 | 344.23 | 4 | ↓ |