In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 20 | Yes |
Popular Name: (1S)-2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-1-phenyl-ethanol (1S)-2-(6-amino-3,4-dihydro-2H-q…
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) | 2.42 | 5.47 | -6.22 | 3 | 3 | 0 | 49 | 268.36 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.42 | 5.92 | -32.91 | 4 | 3 | 1 | 51 | 269.368 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.