In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 18th, 2011 | 24 | Yes |
Popular Name: N-(5-chloro-1-methyl-benzimidazol-2-yl)isoquinoline-1-carboxamide N-(5-chloro-1-methyl-benzimidazo…
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) | 3.89 | 9.98 | -13.36 | 1 | 5 | 0 | 63 | 336.782 | 1 | ↓ |
Lo Low (pH 4.5-6) | 3.89 | 10.59 | -30.36 | 2 | 5 | 1 | 64 | 337.79 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.