In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 27 | Yes |
Popular Name: 2-(azepan-1-ylmethyl)-1-[(4-isopropylphenyl)methyl]benzimidazole 2-(azepan-1-ylmethyl)-1-[(4-isop…
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) | 5.93 | 15.29 | -40.12 | 1 | 3 | 1 | 22 | 362.541 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.93 | 13.68 | -7.53 | 0 | 3 | 0 | 21 | 361.533 | 5 | ↓ |