In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 18 | Yes |
Popular Name: N-[(5-bromo-2-thienyl)methyl]-2-methyl-2-morpholino-propan-1-amine N-[(5-bromo-2-thienyl)methyl]-2-…
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) | 3.01 | 5.23 | -45.21 | 2 | 3 | 1 | 29 | 334.303 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.01 | 3.97 | -2.58 | 1 | 3 | 0 | 24 | 333.295 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.01 | 7.12 | -124.57 | 3 | 3 | 2 | 30 | 335.311 | 5 | ↓ |