In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 17 | Yes |
Popular Name: (1S,2S,4R)-4-tert-butyl-N2-isobutyl-N2-methyl-cyclohexane-1,2-diamine (1S,2S,4R)-4-tert-butyl-N2-isobu…
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) | 3.06 | 7.53 | -113.87 | 4 | 2 | 2 | 32 | 242.451 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.06 | 5.91 | -41.82 | 3 | 2 | 1 | 31 | 241.443 | 4 | ↓ |