In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 23 | No |
Popular Name: 4-amino-3-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide 4-amino-3-nitro-N-(5-pentyl-1,3,…
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) | 2.77 | 6.47 | -26.7 | 3 | 8 | 0 | 127 | 335.389 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 5.57 | -49.95 | 2 | 8 | -1 | 133 | 334.381 | 7 | ↓ |