| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 21 | Yes |
Popular Name: (1S,2R)-2-[[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]carbamoyl]cyclohexanecarboxylic (1S,2R)-2-[[(4S)-4,5,6,7-tetrahy…
| 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) | 1.91 | 7.83 | -60.24 | 1 | 4 | -1 | 69 | 306.407 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.91 | 6.46 | -11.7 | 2 | 4 | 0 | 66 | 307.415 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
