In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 23 | No |
Popular Name: N-isopropyl-N-[(5-methyl-2-furyl)methyl]-2-(3-propyl-5-sulfanyl-1,2,4-triazol-4-yl)acetamide N-isopropyl-N-[(5-methyl-2-furyl…
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) | 2.24 | 10.38 | -54.16 | 0 | 6 | -1 | 64 | 335.453 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.51 | 10.47 | -16.86 | 1 | 6 | 0 | 67 | 336.461 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.