In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 19 | Yes |
Popular Name: (4R)-6,6-dimethyl-1-[(1R)-1-(3-thienyl)ethyl]-5,7-dihydro-4H-indol-4-amine (4R)-6,6-dimethyl-1-[(1R)-1-(3-t…
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) | 1.59 | 7.65 | -40.31 | 3 | 2 | 1 | 33 | 275.441 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 7.34 | -4.34 | 2 | 2 | 0 | 31 | 274.433 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.