In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 30 | Yes |
Popular Name: 2-[[4-(o-tolyl)piperazin-1-yl]methyl]-N-[2-(1-piperidyl)ethyl]thiazole-4-carboxamide 2-[[4-(o-tolyl)piperazin-1-yl]me…
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) | 2.76 | 8.91 | -38.74 | 2 | 6 | 1 | 53 | 428.626 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.76 | 8.92 | -85.1 | 3 | 6 | 2 | 54 | 429.634 | 7 | ↓ |