In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 21 | Yes |
Popular Name: (5-amino-1H-indol-3-yl)-(4-isopropylpiperazin-1-yl)methanone (5-amino-1H-indol-3-yl)-(4-isopr…
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) | 0.67 | 3.17 | -14.85 | 3 | 5 | 0 | 65 | 286.379 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.67 | 5.31 | -46.67 | 4 | 5 | 1 | 67 | 287.387 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.