| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 19 | No |
Popular Name: 3-(aminomethyl)-N-methyl-N-[(3R)-tetrahydrothiophen-3-yl]quinolin-2-amine 3-(aminomethyl)-N-methyl-N-[(3R)…
| 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) | 2.14 | 6.85 | -55.49 | 3 | 3 | 1 | 44 | 274.413 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.14 | 6.45 | -7.11 | 2 | 3 | 0 | 42 | 273.405 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.14 | 7.39 | -108.03 | 4 | 3 | 2 | 45 | 275.421 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
