In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 20 | Yes |
Popular Name: (1R)-2-[(3R)-3-amino-3,4-dihydro-2H-quinolin-1-yl]-1-phenyl-ethanol (1R)-2-[(3R)-3-amino-3,4-dihydro…
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) | 1.71 | 5.03 | -50.29 | 4 | 3 | 1 | 51 | 269.368 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.71 | 4.72 | -5.18 | 3 | 3 | 0 | 49 | 268.36 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.