In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2011 | 21 | Yes |
Popular Name: (2S)-5-[2-dimethylaminoethyl(isobutyl)amino]-2-methyl-2-(propylamino)pentan-1-ol (2S)-5-[2-dimethylaminoethyl(iso…
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) | 2.50 | 4.9 | -89.65 | 4 | 4 | 2 | 45 | 303.535 | 13 | ↓ |
Mid Mid (pH 6-8) | 2.50 | 7.37 | -175.11 | 5 | 4 | 3 | 46 | 304.543 | 13 | ↓ |
Mid Mid (pH 6-8) | 2.50 | 5.58 | -79.19 | 4 | 4 | 2 | 45 | 303.535 | 13 | ↓ |