In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 12th, 2011 | 18 | Yes |
Popular Name: 2-[[[4-(aminomethyl)cyclohexyl]methylamino]methyl]phenol 2-[[[4-(aminomethyl)cyclohexyl]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) | 1.92 | 3.87 | -95.44 | 6 | 3 | 2 | 64 | 250.386 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.92 | 4.57 | -77.35 | 5 | 3 | 1 | 67 | 249.378 | 5 | ↓ |