In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 27 | Yes |
Popular Name: 2-(dimethylamino)-8-(3-ethyl-1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-1-en-4-one 2-(dimethylamino)-8-(3-ethyl-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) | 2.05 | 8.45 | -42.01 | 3 | 7 | 1 | 82 | 368.461 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.05 | 7.47 | -20.21 | 2 | 7 | 0 | 81 | 367.453 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.