In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (1R)-1-(4-tert-butylphenyl)-N-ethyl-N-isobutyl-ethane-1,2-diamine (1R)-1-(4-tert-butylphenyl)-N-et…
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) | 3.93 | 8.99 | -122.25 | 4 | 2 | 2 | 32 | 278.484 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.93 | 7.91 | -29.46 | 3 | 2 | 1 | 30 | 277.476 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.93 | 8.02 | -45.5 | 3 | 2 | 1 | 31 | 277.476 | 7 | ↓ |