In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 12 | No |
Popular Name: 4-(3-methoxypropyl)-3-methyl-1H-1,2,4-triazole-5-thione 4-(3-methoxypropyl)-3-methyl-1H-…
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) | -0.21 | 4.71 | -15.2 | 1 | 4 | 0 | 43 | 187.268 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.52 | 4.55 | -47.63 | 0 | 4 | -1 | 40 | 186.26 | 4 | ↓ |