In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2010 | 19 | Yes |
Popular Name: N-[(2S)-2-(4-tert-butylpiperazin-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2S)-2-(4-tert-butylpiperazin…
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) | 2.68 | 7.18 | -87.62 | 3 | 3 | 2 | 24 | 269.477 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.68 | 5.03 | -33.13 | 2 | 3 | 1 | 23 | 268.469 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.