In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 21 | Yes |
Popular Name: N-[2-(5-amino-1H-benzimidazol-2-yl)ethyl]-N',N'-dimethyl-N-propyl-ethane-1,2-diamine N-[2-(5-amino-1H-benzimidazol-2-…
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) | 1.70 | 5.05 | -38.76 | 4 | 5 | 1 | 62 | 290.435 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.70 | 2.58 | -7.69 | 3 | 5 | 0 | 61 | 289.427 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.70 | 4.74 | -40.74 | 4 | 5 | 1 | 62 | 290.435 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.70 | 7.2 | -119.04 | 5 | 5 | 2 | 64 | 291.443 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.70 | 5.45 | -80.56 | 5 | 5 | 2 | 64 | 291.443 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.70 | 7.6 | -197.61 | 6 | 5 | 3 | 65 | 292.451 | 8 | ↓ |