In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2011 | 18 | Yes |
Popular Name: 4-methyl-N1-[(1R)-1-(2-thienyl)butyl]benzene-1,3-diamine 4-methyl-N1-[(1R)-1-(2-thienyl)b…
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) | 4.57 | 7.21 | -3.87 | 3 | 2 | 0 | 38 | 260.406 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.