In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 19 | Yes |
Popular Name: (5-amino-1H-indol-3-yl)-(4-methylpiperazin-1-yl)methanone (5-amino-1H-indol-3-yl)-(4-methy…
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) | 0.00 | 1.8 | -15.11 | 3 | 5 | 0 | 65 | 258.325 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.00 | 4.15 | -50.18 | 4 | 5 | 1 | 67 | 259.333 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.