| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 20 | Yes |
Popular Name: (4S)-1-methyl-4-[[(1R)-1-(3-thienyl)ethyl]amino]-3,4-dihydroquinolin-2-one (4S)-1-methyl-4-[[(1R)-1-(3-thie…
| 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) | 1.16 | 7.91 | -47.65 | 2 | 3 | 1 | 37 | 287.408 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.16 | 7.27 | -7.11 | 1 | 3 | 0 | 32 | 286.4 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
