In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | Yes |
Popular Name: (1S)-N-[(1S)-1-(3-bromo-2-thienyl)ethyl]tetralin-1-amine (1S)-N-[(1S)-1-(3-bromo-2-thieny…
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) | 4.15 | 10.03 | -34.16 | 2 | 1 | 1 | 17 | 337.306 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.15 | 9.21 | -2.46 | 1 | 1 | 0 | 12 | 336.298 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.