In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 18 | Yes |
Popular Name: (5-bromo-2-furyl)-[4-[(1S)-1-methylpropyl]piperazin-1-yl]methanone (5-bromo-2-furyl)-[4-[(1S)-1-met…
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) | 2.67 | 7.12 | -37.21 | 1 | 4 | 1 | 38 | 316.219 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.67 | 5.17 | -4.38 | 0 | 4 | 0 | 37 | 315.211 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.