In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 16 | No |
Popular Name: N-[(1S)-2-methyl-1-(2-thienyl)propyl]tetrahydrothiopyran-4-amine N-[(1S)-2-methyl-1-(2-thienyl)pr…
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) | 3.62 | 8.41 | -36.51 | 2 | 1 | 1 | 17 | 256.46 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.62 | 7.68 | -2.01 | 1 | 1 | 0 | 12 | 255.452 | 4 | ↓ |