In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2009 | 25 | Yes |
Popular Name: N-[[4-(benzimidazol-1-yl)phenyl]methyl]-3-imidazol-1-yl-propan-1-amine N-[[4-(benzimidazol-1-yl)phenyl]…
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) | 2.28 | 13.78 | -114.19 | 3 | 5 | 2 | 54 | 333.439 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.28 | 11.91 | -14.08 | 1 | 5 | 0 | 48 | 331.423 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.28 | 14.26 | -157.44 | 4 | 5 | 3 | 55 | 334.447 | 7 | ↓ |