| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 13th, 2008 | 14 | Yes |
Popular Name: MFCD09729110 MFCD09729110
Find On: PubMed — Wikipedia — Google
CAS Number: 953903-71-4
None
| 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) | 1.19 | 4.1 | -98.6 | 4 | 3 | 2 | 45 | 193.294 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.19 | 3.28 | -4.31 | 2 | 3 | 0 | 42 | 191.278 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.19 | 3.68 | -45.96 | 3 | 3 | 1 | 44 | 192.286 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
