In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 4th, 2009 | 21 | Yes |
Popular Name: N-[(3-chlorophenyl)methyl]-1-(4-phenyl-1,2,4-triazol-3-yl)methanamine N-[(3-chlorophenyl)methyl]-1-(4-…
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) | 2.45 | 11.01 | -48.15 | 2 | 4 | 1 | 47 | 299.785 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.45 | 9.61 | -9.35 | 1 | 4 | 0 | 43 | 298.777 | 5 | ↓ |