In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 32 | Yes |
Popular Name: N-[2-(4-ethylpiperazin-1-yl)ethyl]-3-[1-[(2-fluorophenyl)methyl]indol-3-yl]propanamide N-[2-(4-ethylpiperazin-1-yl)ethy…
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) | 3.97 | 12.24 | -43.28 | 2 | 5 | 1 | 42 | 437.583 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.97 | 9.93 | -12.82 | 1 | 5 | 0 | 41 | 436.575 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.97 | 12.25 | -45.52 | 2 | 5 | 1 | 42 | 437.583 | 9 | ↓ |