| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 21 | Yes |
Popular Name: (1S,6S)-6-[[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylic (1S,6S)-6-[[(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) | 1.42 | 8.53 | -54.04 | 1 | 4 | -1 | 69 | 304.391 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.42 | 6.72 | -11.87 | 2 | 4 | 0 | 66 | 305.399 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
