In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 20 | Yes |
Popular Name: (1S)-1-(4-bromophenyl)-3-indolin-1-yl-propan-1-amine (1S)-1-(4-bromophenyl)-3-indolin…
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) | 2.23 | 9.06 | -55.81 | 3 | 2 | 1 | 31 | 332.265 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 8.72 | -5.2 | 2 | 2 | 0 | 29 | 331.257 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.