In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2011 | 26 | Yes |
Popular Name: 2-[[(2S)-2-[4-(p-tolyl)piperazin-1-yl]propyl]amino]benzamide 2-[[(2S)-2-[4-(p-tolyl)piperazin…
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) | 2.96 | 7.72 | -35.45 | 4 | 5 | 1 | 63 | 353.49 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.96 | 5.74 | -8.53 | 3 | 5 | 0 | 62 | 352.482 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.