| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 20 | Yes |
Popular Name: 6-amino-7-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3,4-dihydro-1H-quinolin-2-one 6-amino-7-[(3S)-3-(dimethylamino…
| 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) | 1.26 | 5.18 | -41.7 | 4 | 5 | 1 | 63 | 275.376 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.26 | 2.8 | -7.45 | 3 | 5 | 0 | 62 | 274.368 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.26 | 5.08 | -108.33 | 5 | 5 | 2 | 64 | 276.384 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
