| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2008 | 10 | No |
Popular Name: cis-urocanic acid cis-urocanic acid
Find On: PubMed — Wikipedia — Google
CAS Number: 104-98-3
| 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) | -0.04 | 4.84 | -44.06 | 2 | 4 | 0 | 70 | 138.126 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.04 | 2.94 | -47.2 | 1 | 4 | -1 | 69 | 137.118 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 217 - 220 | Acros Organics |
| S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
