In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2011 | 26 | Yes |
Popular Name: 2-(4-tert-butylphenyl)-N-(imidazo[1,5-a]pyridin-3-ylmethyl)ethanesulfonamide 2-(4-tert-butylphenyl)-N-(imidaz…
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) | 3.65 | 8.81 | -17.58 | 1 | 5 | 0 | 63 | 371.506 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.65 | 9.27 | -40.39 | 2 | 5 | 1 | 65 | 372.514 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.