In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 17 | Yes |
Popular Name: (4R)-4-(cyclopropylmethylamino)-6,7-dihydro-5H-benzothiophene-4-carboxamide (4R)-4-(cyclopropylmethylamino)-…
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) | 1.76 | 3.97 | -44.18 | 4 | 3 | 1 | 60 | 251.375 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.76 | 3.02 | -5.45 | 3 | 3 | 0 | 55 | 250.367 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.