In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 21 | Yes |
Popular Name: 3-amino-N-[[(2S)-tetrahydrofuran-2-yl]methyl]-N-(2-thienylmethyl)thiophene-2-carboxamide 3-amino-N-[[(2S)-tetrahydrofuran…
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) | 2.36 | 5.85 | -10.37 | 2 | 4 | 0 | 56 | 322.455 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.36 | 5.82 | -34.87 | 3 | 4 | 1 | 57 | 323.463 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.