In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 24 | Yes |
Popular Name: (3-chloro-1-methyl-indol-2-yl)-[4-(2-hydroxy-2-methyl-propyl)piperazin-1-yl]methanone (3-chloro-1-methyl-indol-2-yl)-[…
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) | 2.58 | 6.06 | -10.4 | 1 | 5 | 0 | 49 | 349.862 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.58 | 7.71 | -44.86 | 2 | 5 | 1 | 50 | 350.87 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.