In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 24 | Yes |
Popular Name: [1-(2-methoxyethyl)-2,3-dimethyl-indol-5-yl]-(4-methylpiperazin-1-yl)methanone [1-(2-methoxyethyl)-2,3-dimethyl…
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) | 1.64 | 8.98 | -46.56 | 1 | 5 | 1 | 39 | 330.452 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 6.63 | -9.65 | 0 | 5 | 0 | 38 | 329.444 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.