In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 17 | Yes |
Popular Name: (2S)-N-[(5-bromo-2-thienyl)methyl]-2-phenyl-propan-1-amine (2S)-N-[(5-bromo-2-thienyl)methy…
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) | 4.93 | 8.03 | -2.67 | 1 | 1 | 0 | 12 | 310.26 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.93 | 9.43 | -47.36 | 2 | 1 | 1 | 17 | 311.268 | 5 | ↓ |