In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 18 | Yes |
Popular Name: (1-cyclopropylpyrrol-2-yl)-[(2R,6R)-2,6-dimethylpiperazin-1-yl]methanone (1-cyclopropylpyrrol-2-yl)-[(2R,…
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) | 0.92 | 6.23 | -47.02 | 2 | 4 | 1 | 42 | 248.35 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.92 | 5.12 | -8.6 | 1 | 4 | 0 | 37 | 247.342 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.