In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 21 | Yes |
Popular Name: N-[[3-(aminomethyl)benzofuran-2-yl]methyl]-N-(2-thienylmethyl)ethanamine N-[[3-(aminomethyl)benzofuran-2-…
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) | 3.09 | 8.51 | -116.9 | 4 | 3 | 2 | 45 | 302.443 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.09 | 6.34 | -49 | 3 | 3 | 1 | 44 | 301.435 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.