| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 25th, 2009 | 14 | Yes |
Popular Name: 3-AMINO-3- -PROPIONICACID 3-AMINO-3- -PROPIONICACID
Find On: PubMed — Wikipedia — Google
CAS Number: 188812-95-5
3-Amino-3-(3,5-dichloro-phenyl)-propionic acid
3-amino-3-(3,5-dichlorophenyl)propanoic acid
| 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) | 0.23 | 5.04 | -37.59 | 3 | 3 | 0 | 68 | 234.082 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.23 | 4.71 | -38.4 | 2 | 3 | -1 | 66 | 233.074 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 204 - 206 | Enamine Building Blocks |
| MP | 204...206 | Enamine Building Blocks |
| MP | 205 - 207 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.