In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 30 | Yes |
Popular Name: 1-[5-[3-(1,4-diazepan-1-ylmethyl)-6-methyl-imidazo[1,2-a]pyridin-2-yl]indolin-1-yl]ethanone 1-[5-[3-(1,4-diazepan-1-ylmethyl…
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) | 2.42 | 11.4 | -51.69 | 2 | 6 | 1 | 57 | 404.538 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.42 | 8.76 | -18.96 | 1 | 6 | 0 | 53 | 403.53 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.42 | 11.49 | -84.79 | 3 | 6 | 2 | 59 | 405.546 | 3 | ↓ |