| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 21 | No |
Popular Name: (1S)-1-(2-furyl)-N'-[(4R)-isothiochroman-4-yl]-N,N-dimethyl-ethane-1,2-diamine (1S)-1-(2-furyl)-N'-[(4R)-isothi…
| 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) | 2.86 | 6.56 | -4.28 | 1 | 3 | 0 | 28 | 302.443 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.86 | 9.62 | -120.02 | 3 | 3 | 2 | 34 | 304.459 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
