In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 17 | Yes |
Popular Name: (2R)-1-[benzyl(ethyl)amino]-3-(ethylamino)propan-2-ol (2R)-1-[benzyl(ethyl)amino]-3-(e…
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) | 1.28 | 3.35 | -37.51 | 3 | 3 | 1 | 40 | 237.367 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.28 | 1.92 | -3.29 | 2 | 3 | 0 | 35 | 236.359 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.28 | 4.3 | -34.87 | 3 | 3 | 1 | 37 | 237.367 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.28 | 6.26 | -37.84 | 3 | 3 | 1 | 44 | 237.367 | 8 | ↓ |