In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 11 | No |
Popular Name: N-methyl-N-[(3R)-tetrahydrothiophen-3-yl]azetidin-3-amine N-methyl-N-[(3R)-tetrahydrothiop…
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) | 0.62 | 1.69 | -39.74 | 2 | 2 | 1 | 20 | 173.305 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.62 | 0.01 | -2.81 | 1 | 2 | 0 | 15 | 172.297 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.62 | 2.23 | -36.84 | 2 | 2 | 1 | 16 | 173.305 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.