In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 20 | Yes |
Popular Name: (1S,2S)-2-(2-methylbenzimidazol-1-yl)-1-phenyl-propan-1-amine (1S,2S)-2-(2-methylbenzimidazol-…
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) | 1.06 | 8.18 | -50.28 | 3 | 3 | 1 | 45 | 266.368 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.06 | 7.9 | -6.58 | 2 | 3 | 0 | 44 | 265.36 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.06 | 8.59 | -108.33 | 4 | 3 | 2 | 47 | 267.376 | 3 | ↓ |