In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 20 | Yes |
Popular Name: (1S,2S)-2-(benzimidazol-1-yl)-1-phenyl-butan-1-amine (1S,2S)-2-(benzimidazol-1-yl)-1-…
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) | 1.48 | 9.23 | -50.79 | 3 | 3 | 1 | 45 | 266.368 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.48 | 8.93 | -6.54 | 2 | 3 | 0 | 44 | 265.36 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.48 | 9.69 | -116.27 | 4 | 3 | 2 | 47 | 267.376 | 4 | ↓ |