In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 28 | Yes |
Popular Name: 2-(4-tert-butylphenyl)-3-(1,4-diazepan-1-ylmethyl)-5-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) | 4.12 | 11.47 | -78.39 | 3 | 4 | 2 | 38 | 378.564 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.12 | 10.35 | -8.72 | 1 | 4 | 0 | 33 | 376.548 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.12 | 11.43 | -47.37 | 2 | 4 | 1 | 37 | 377.556 | 4 | ↓ |