In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 28 | Yes |
Popular Name: 2-(4-tert-butylphenyl)-3-(1,4-diazepan-1-ylmethyl)-8-methyl-imidazo[1,2-a]pyridine 2-(4-tert-butylphenyl)-3-(1,4-di…
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) | 4.69 | 10.95 | -45.87 | 2 | 4 | 1 | 37 | 377.556 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.69 | 11.26 | -9.18 | 1 | 4 | 0 | 33 | 376.548 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.69 | 11.54 | -78.55 | 3 | 4 | 2 | 38 | 378.564 | 4 | ↓ |