In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2011 | 27 | Yes |
Popular Name: (2-bromophenyl)-[4-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]piperazin-1-yl]methanone (2-bromophenyl)-[4-[2-(1-methylp…
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) | 2.68 | 10.01 | -15.59 | 0 | 5 | 0 | 41 | 427.346 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.68 | 12.21 | -56.76 | 1 | 5 | 1 | 43 | 428.354 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.