In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 20 | Yes |
Popular Name: (1R)-N-[[5-(ethylaminomethyl)-2-methyl-3-furyl]methyl]-N-methyl-1-(2-thienyl)ethanamine (1R)-N-[[5-(ethylaminomethyl)-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) | 2.94 | 9.37 | -90.46 | 3 | 3 | 2 | 34 | 294.464 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.94 | 7 | -38.63 | 2 | 3 | 1 | 33 | 293.456 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.