In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2011 | 15 | Yes |
Popular Name: 1-methyl-3-(2-thienyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine 1-methyl-3-(2-thienyl)-4,5,6,7-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) | 1.61 | 3.53 | -9.37 | 1 | 3 | 0 | 30 | 219.313 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.61 | 4.88 | -47.48 | 2 | 3 | 1 | 34 | 220.321 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.