In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 20 | Yes |
Popular Name: 1-(5-bromo-2-propoxy-phenyl)-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]methanamine 1-(5-bromo-2-propoxy-phenyl)-N-[…
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) | 2.19 | 9.05 | -49.14 | 2 | 5 | 1 | 57 | 340.245 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.19 | 7.67 | -10.88 | 1 | 5 | 0 | 52 | 339.237 | 7 | ↓ |