In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 21 | Yes |
Popular Name: (3R)-N-[3-(benzimidazol-1-yl)propyl]-1-isopropyl-pyrrolidin-3-amine (3R)-N-[3-(benzimidazol-1-yl)pro…
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) | 2.38 | 7.97 | -52.51 | 2 | 4 | 1 | 38 | 287.431 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.38 | 6.81 | -8.86 | 1 | 4 | 0 | 33 | 286.423 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.38 | 10.8 | -183.84 | 4 | 4 | 3 | 40 | 289.447 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.38 | 9.65 | -76.42 | 3 | 4 | 2 | 36 | 288.439 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.38 | 9.17 | -39.86 | 2 | 4 | 1 | 34 | 287.431 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.38 | 8.45 | -99.8 | 3 | 4 | 2 | 39 | 288.439 | 6 | ↓ |