In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2011 | 16 | Yes |
Popular Name: (4S)-1-[(1R)-2-cyclopropyl-1-methyl-ethyl]-4,5,6,7-tetrahydroindol-4-amine (4S)-1-[(1R)-2-cyclopropyl-1-met…
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) | 0.66 | 7.38 | -38.29 | 3 | 2 | 1 | 33 | 219.352 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.66 | 7.06 | -3.75 | 2 | 2 | 0 | 31 | 218.344 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.