In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 22 | Yes |
Popular Name: 5-[3-(benzenesulfonyl)propyl]-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine 5-[3-(benzenesulfonyl)propyl]-1-…
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) | 0.24 | 6.45 | -39.67 | 1 | 5 | 1 | 56 | 320.438 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.24 | 5.99 | -18.74 | 0 | 5 | 0 | 55 | 319.43 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.24 | 8.21 | -54.51 | 1 | 5 | 1 | 56 | 320.438 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.