In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2009 | 18 | Yes |
Popular Name: N-[(1-propylbenzimidazol-2-yl)methyl]propane-1,3-diamine N-[(1-propylbenzimidazol-2-yl)me…
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) | 1.12 | 4.05 | -49.88 | 4 | 4 | 1 | 57 | 247.366 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.12 | 4.55 | -83.42 | 5 | 4 | 2 | 59 | 248.374 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.12 | 5.4 | -119.02 | 5 | 4 | 2 | 62 | 248.374 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.12 | 5.91 | -198.42 | 6 | 4 | 3 | 63 | 249.382 | 7 | ↓ |