In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 22 | Yes |
Popular Name: 1-(1,3-benzodioxol-5-yl)-N-[(5-chloro-1H-benzimidazol-2-yl)methyl]methanamine 1-(1,3-benzodioxol-5-yl)-N-[(5-c…
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) | 3.04 | 6.17 | -59.23 | 3 | 5 | 1 | 64 | 316.768 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.04 | 4.82 | -11.1 | 2 | 5 | 0 | 59 | 315.76 | 4 | ↓ |