In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 20 | Yes |
Popular Name: (2S)-1-[[(1R)-2-(diethylamino)-1-methyl-ethyl]amino]-3-(2-isopropoxyethoxy)propan-2-ol (2S)-1-[[(1R)-2-(diethylamino)-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) | 1.08 | 2.87 | -36.85 | 3 | 5 | 1 | 59 | 291.456 | 13 | ↓ |
Mid Mid (pH 6-8) | 1.08 | 3.26 | -31.94 | 3 | 5 | 1 | 55 | 291.456 | 13 | ↓ |
Lo Low (pH 4.5-6) | 1.08 | 4.56 | -111.18 | 4 | 5 | 2 | 60 | 292.464 | 13 | ↓ |