In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 20 | No |
Popular Name: 5-[benzyl(isopropyl)amino]-4-propyl-1,2,4-triazole-3-thiol 5-[benzyl(isopropyl)amino]-4-pro…
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) | 2.82 | 11.99 | -10.87 | 1 | 4 | 0 | 37 | 290.436 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.55 | 12.26 | -49.25 | 0 | 4 | -1 | 34 | 289.428 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.