In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 18th, 2011 | 33 | Yes |
Popular Name: 7-[(3R)-1-benzylazepan-3-yl]-2-ureido-4,5-dihydrothieno[2,3-e]indazole-3-carboxamide 7-[(3R)-1-benzylazepan-3-yl]-2-u…
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) | 2.61 | 6.02 | -49.85 | 6 | 8 | 1 | 120 | 465.603 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.61 | 3.97 | -15.12 | 5 | 8 | 0 | 119 | 464.595 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.