In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 20 | Yes |
Popular Name: 1-(aminomethyl)-4-tert-butyl-N-methyl-N-(thiazol-4-ylmethyl)cyclohexanamine 1-(aminomethyl)-4-tert-butyl-N-m…
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) | 2.79 | 4.22 | -39.2 | 3 | 3 | 1 | 44 | 296.504 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.79 | 6.09 | -116.8 | 4 | 3 | 2 | 45 | 297.512 | 5 | ↓ |