In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 21 | Yes |
Popular Name: [3-(2-aminoethyl)phenyl]-[4-(cyclopropylmethyl)piperazin-1-yl]methanone [3-(2-aminoethyl)phenyl]-[4-(cyc…
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) | 0.63 | 7.25 | -94.15 | 4 | 4 | 2 | 52 | 289.423 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.63 | 5.05 | -49.44 | 3 | 4 | 1 | 51 | 288.415 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.