In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2004 | 26 | No |
Popular Name: 4-[(E)-[3-(4-bromobenzyl)oxybenzylidene]amino]-5-propyl-1,2,4-triazole-3-thiolate 4-[(E)-[3-(4-bromobenzyl)oxybenz…
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) | 5.21 | 12.86 | -50.05 | 0 | 5 | -1 | 52 | 430.351 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.48 | 13.02 | -14.91 | 1 | 5 | 0 | 55 | 431.359 | 7 | ↓ |