In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 16 | No |
Popular Name: N-[2,2-dimethyl-3-[(3S)-3-methylthiomorpholin-4-yl]propyl]cyclopropanamine N-[2,2-dimethyl-3-[(3S)-3-methyl…
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) | 2.37 | 5.33 | -38.22 | 2 | 2 | 1 | 20 | 243.44 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.37 | 7.41 | -99.31 | 3 | 2 | 2 | 21 | 244.448 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.