In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 19 | Yes |
Popular Name: 4-amino-N-[(5-chloro-2-thienyl)methyl]-N-ethyl-5-methyl-thiophene-2-carboxamide 4-amino-N-[(5-chloro-2-thienyl)m…
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) | 3.38 | 6.63 | -7.51 | 2 | 3 | 0 | 46 | 314.863 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.38 | 6.41 | -44.78 | 3 | 3 | 1 | 48 | 315.871 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.