In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 29 | No |
Popular Name: 2-(butanoylamino)-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide 2-(butanoylamino)-N-[5-(4-nitrop…
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) | 3.99 | 9.52 | -17.95 | 2 | 9 | 0 | 130 | 411.443 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.06 | 8.02 | -42.53 | 1 | 9 | -1 | 136 | 410.435 | 7 | ↓ |