In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (1R)-1-(4-tert-butylphenyl)-N'-[(1S)-1-cyclopropylethyl]-N,N'-dimethyl-ethane-1,2-diamine (1R)-1-(4-tert-butylphenyl)-N'-[…
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) | 4.62 | 11.42 | -117.9 | 3 | 2 | 2 | 21 | 290.495 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.62 | 9.38 | -34.63 | 2 | 2 | 1 | 20 | 289.487 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.62 | 10.31 | -30.74 | 2 | 2 | 1 | 16 | 289.487 | 7 | ↓ |