In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | Yes |
Popular Name: N-[(1S)-1-(2,4,6-trimethyl-3-pyridyl)ethyl]-1H-indol-5-amine N-[(1S)-1-(2,4,6-trimethyl-3-pyr…
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) | 3.92 | 8.31 | -31.59 | 3 | 3 | 1 | 42 | 280.395 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.92 | 7.93 | -8.24 | 2 | 3 | 0 | 41 | 279.387 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.