In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 11th, 2011 | 21 | Yes |
Popular Name: (2S)-N-methyl-1-[5-(2-methyl-8-quinolyl)-2-furyl]propan-2-amine (2S)-N-methyl-1-[5-(2-methyl-8-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) | 3.42 | 8.83 | -36.67 | 2 | 3 | 1 | 43 | 281.379 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.42 | 9.25 | -76.9 | 3 | 3 | 2 | 44 | 282.387 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.