In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 21 | No |
Popular Name: (1R,2S,3S)-2,3-dimethyl-N-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]cyclohexanamine (1R,2S,3S)-2,3-dimethyl-N-[(1S)-…
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) | 4.78 | 10.5 | -49.27 | 2 | 4 | 1 | 62 | 291.415 | 4 | ↓ |