In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2010 | 21 | Yes |
Popular Name: 1-(4-methyl-1,2,4-triazol-3-yl)-N-[(3-phenylphenyl)methyl]methanamine 1-(4-methyl-1,2,4-triazol-3-yl)-…
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) | 2.29 | 10.74 | -55.6 | 2 | 4 | 1 | 47 | 279.367 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.29 | 9.39 | -14.56 | 1 | 4 | 0 | 43 | 278.359 | 5 | ↓ |