In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 21 | Yes |
Popular Name: (1S)-1-(3-bromophenyl)-N-[2-(1H-indol-3-yl)ethyl]ethanamine (1S)-1-(3-bromophenyl)-N-[2-(1H-…
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) | 4.80 | 9.16 | -6.45 | 2 | 2 | 0 | 28 | 343.268 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.80 | 10.44 | -46.72 | 3 | 2 | 1 | 32 | 344.276 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.