In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 17 | Yes |
Popular Name: (1R,3S)-1-(aminomethyl)-N,3-dimethyl-N-(3-thienylmethyl)cyclohexanamine (1R,3S)-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) | 2.12 | 4.73 | -45.03 | 3 | 2 | 1 | 31 | 253.435 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.12 | 6.63 | -124.74 | 4 | 2 | 2 | 32 | 254.443 | 4 | ↓ |