| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2011 | 12 | Yes |
Popular Name: 3-(aminomethyl)-2,3-dihydro-1H-inden-1-one 3-(aminomethyl)-2,3-dihydro-1H-i…
Find On: PubMed — Wikipedia — Google
CAS Number: 1267266-05-6
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) | 0.32 | 3.43 | -57.96 | 3 | 2 | 1 | 45 | 162.212 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.32 | 3.05 | -6.53 | 2 | 2 | 0 | 43 | 161.204 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.
