In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 26 | Yes |
Popular Name: 2,5-dichloro-N-[(1R)-1-(4-ethylpiperazine-1-carbonyl)-2-methyl-propyl]benzenesulfonamide 2,5-dichloro-N-[(1R)-1-(4-ethylp…
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) | 3.02 | 4.44 | -14.19 | 1 | 6 | 0 | 70 | 422.378 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.02 | 3.93 | -44.21 | 0 | 6 | -1 | 72 | 421.37 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.02 | 6.66 | -49.48 | 2 | 6 | 1 | 71 | 423.386 | 6 | ↓ |