In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2009 | 17 | Yes |
Popular Name: 1-[(1S)-3-(3-chlorophenyl)-1-methyl-propyl]piperazine 1-[(1S)-3-(3-chlorophenyl)-1-met…
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) | 2.95 | 6.43 | -42.52 | 2 | 2 | 1 | 20 | 253.797 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.95 | 8.41 | -123.24 | 3 | 2 | 2 | 21 | 254.805 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.95 | 7.02 | -37.25 | 2 | 2 | 1 | 16 | 253.797 | 4 | ↓ |