In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2010 | 30 | No |
Popular Name: 4-(3-methylbutanoylamino)-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide 4-(3-methylbutanoylamino)-N-[5-(…
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) | 4.25 | 9.7 | -24 | 2 | 9 | 0 | 130 | 425.47 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.32 | 7.32 | -47.71 | 1 | 9 | -1 | 136 | 424.462 | 7 | ↓ |