In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 21 | Yes |
Popular Name: (1S,2R)-1-(4-chlorophenyl)-1-(2-methylbenzimidazol-1-yl)propan-2-amine (1S,2R)-1-(4-chlorophenyl)-1-(2-…
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) | 3.05 | 7.92 | -59.15 | 3 | 3 | 1 | 45 | 300.813 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.05 | 7.62 | -9 | 2 | 3 | 0 | 44 | 299.805 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 8.36 | -104.74 | 4 | 3 | 2 | 47 | 301.821 | 3 | ↓ |