In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 12 | Yes |
Popular Name: (1S,2S)-N-[(5-bromo-2-thienyl)methyl]-2-methyl-cyclopropanamine (1S,2S)-N-[(5-bromo-2-thienyl)me…
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) | 3.30 | 6.49 | -38.77 | 2 | 1 | 1 | 17 | 247.181 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.30 | 5.2 | -1.53 | 1 | 1 | 0 | 12 | 246.173 | 3 | ↓ |