In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2008 | 15 | Yes |
Popular Name: 1-amino-3-(3,4-dihydroisoquinolin-2(1H)-yl)propan-2-ol 1-amino-3-(3,4-dihydroisoquinoli…
Find On: PubMed — Wikipedia — Google
CAS Number: 954279-15-3
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) | -0.11 | 0.35 | -51.22 | 4 | 3 | 1 | 51 | 207.297 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.11 | -0.03 | -6.03 | 3 | 3 | 0 | 49 | 206.289 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 59 - 61 | Enamine Building Blocks |
MP | 59...61 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |