In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 17 | Yes |
Popular Name: (1S,3R)-1-(aminomethyl)-N,3-dimethyl-N-[(1S)-1,2,2-trimethylpropyl]cyclohexanamine (1S,3R)-1-(aminomethyl)-N,3-dime…
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) | 3.16 | 6.64 | -113.4 | 4 | 2 | 2 | 32 | 242.451 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.16 | 5.31 | -40.53 | 3 | 2 | 1 | 31 | 241.443 | 4 | ↓ |