In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 15th, 2012 | 24 | Yes |
Popular Name: N2,N2,1-trimethyl-N6-(2-thienylmethyl)pyrrolo[3,2-b]pyridine-2,6-dicarboxamide N2,N2,1-trimethyl-N6-(2-thienylm…
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) | 1.48 | 5.27 | -12.75 | 1 | 6 | 0 | 67 | 342.424 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.48 | 5.74 | -42.64 | 2 | 6 | 1 | 68 | 343.432 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.