In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 19 | Yes |
Popular Name: 2-methyl-1-[[(2S)-1-methyl-2-piperidyl]methyl]benzimidazol-5-amine 2-methyl-1-[[(2S)-1-methyl-2-pip…
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) | 1.56 | 6.92 | -48.07 | 3 | 4 | 1 | 48 | 259.377 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.56 | 4.61 | -8.58 | 2 | 4 | 0 | 47 | 258.369 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.56 | 7.36 | -89.54 | 4 | 4 | 2 | 50 | 260.385 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.