In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2010 | 17 | No |
Popular Name: N'-amino-N-cyclopropyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamidine N'-amino-N-cyclopropyl-5,6,7,8-t…
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) | 1.44 | 6.96 | -24.3 | 4 | 3 | 1 | 52 | 250.391 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 6.95 | -23.97 | 4 | 3 | 1 | 52 | 250.391 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.