In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 21 | Yes |
Popular Name: (1S,2R)-1-(3,4-dihydro-2H-quinolin-1-yl)-1-(3-methyl-2-thienyl)butan-2-amine (1S,2R)-1-(3,4-dihydro-2H-quinol…
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) | 4.15 | 8.22 | -44.28 | 3 | 2 | 1 | 31 | 301.479 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.15 | 7.91 | -2.84 | 2 | 2 | 0 | 29 | 300.471 | 4 | ↓ |