| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 15 | No |
Popular Name: (1R)-N-methyl-N-[(3R)-tetrahydrothiophen-3-yl]-1-(3-thienyl)ethane-1,2-diamine (1R)-N-methyl-N-[(3R)-tetrahydro…
| 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) | 0.96 | 3.66 | -52.46 | 3 | 2 | 1 | 31 | 243.421 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.96 | 4.81 | -126.63 | 4 | 2 | 2 | 32 | 244.429 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
