In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 18 | Yes |
Popular Name: (1R,2R)-N-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]-2-phenyl-cyclopropanamine (1R,2R)-N-[(4,5-dimethyl-1,2,4-t…
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) | 0.91 | 7.44 | -11.31 | 1 | 4 | 0 | 43 | 242.326 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.91 | 8.75 | -47.25 | 2 | 4 | 1 | 47 | 243.334 | 4 | ↓ |