In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 21 | Yes |
Popular Name: 2-methoxy-N-[[(6S)-6-phenyl-4,5,6,7-tetrahydro-1H-benzimidazol-2-yl]methyl]ethanamine 2-methoxy-N-[[(6S)-6-phenyl-4,5,…
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) | 2.61 | 6.27 | -28.86 | 3 | 4 | 1 | 51 | 286.399 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.61 | 5.58 | -8.14 | 2 | 4 | 0 | 50 | 285.391 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.61 | 7.64 | -111.83 | 4 | 4 | 2 | 56 | 287.407 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.61 | 6.92 | -42.51 | 3 | 4 | 1 | 55 | 286.399 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.