In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | Yes |
Popular Name: (2S)-1-(2-dimethylaminoethylamino)-3-(3,5-dimethylphenoxy)propan-2-ol (2S)-1-(2-dimethylaminoethylamin…
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) | 1.64 | 5.24 | -116.62 | 4 | 4 | 2 | 51 | 268.401 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.64 | 1.37 | -6.04 | 2 | 4 | 0 | 45 | 266.385 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 3.84 | -38.36 | 3 | 4 | 1 | 46 | 267.393 | 8 | ↓ |