In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 29 | Yes |
Popular Name: 4,5-dimethyl-2-[[2-[4-(4-methylbenzoyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxamide 4,5-dimethyl-2-[[2-[4-(4-methylb…
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) | 1.54 | 3.88 | -18.78 | 3 | 7 | 0 | 96 | 414.531 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.54 | 6.04 | -58.3 | 4 | 7 | 1 | 97 | 415.539 | 5 | ↓ |