| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2011 | 18 | Yes |
Popular Name: 3-[[(1R)-1-(3-methyl-2-thienyl)ethyl]amino]-1-pyrrolidin-1-yl-propan-1-one 3-[[(1R)-1-(3-methyl-2-thienyl)e…
| 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) | 2.36 | 6.96 | -40.99 | 2 | 3 | 1 | 37 | 267.418 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.36 | 5.76 | -8.01 | 1 | 3 | 0 | 32 | 266.41 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
