In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 34 | No |
Popular Name: N-[(1S)-1-[5-[(2-methylbenzyl)thio]-4-(4-nitrophenyl)-1,2,4-triazol-3-yl]ethyl]benzamide N-[(1S)-1-[5-[(2-methylbenzyl)th…
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) | 4.86 | 15.11 | -12.11 | 1 | 8 | 0 | 106 | 473.558 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.