In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 20 | Yes |
Popular Name: 3-amino-N-ethyl-N-[(1R)-1-(3-hydroxyphenyl)ethyl]thiophene-2-carboxamide 3-amino-N-ethyl-N-[(1R)-1-(3-hyd…
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) | 2.52 | 3.62 | -11.83 | 3 | 4 | 0 | 67 | 290.388 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.52 | 3.52 | -36.33 | 4 | 4 | 1 | 68 | 291.396 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.