In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 18 | Yes |
Popular Name: (1S,2R,4R)-4-tert-butyl-N2-methyl-N2-[(1S)-1-methylbutyl]cyclohexane-1,2-diamine (1S,2R,4R)-4-tert-butyl-N2-methy…
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) | 3.71 | 7.54 | -119.29 | 4 | 2 | 2 | 32 | 256.478 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.71 | 5.8 | -38.86 | 3 | 2 | 1 | 31 | 255.47 | 5 | ↓ |